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Archive October 2019

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Subject: Chemistry
,
Working Paper
, Title:

Let’s Uncomplicate: Mg Complexes in Mg3Sb2

, Authors: Prashun Gorai, Vladan Stevanovic
Version undefined posted 01 October 2019
Posted
Oct 01, 2019
10.26434/chemrxiv.9916661.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Ag- and Cu-Promoted Mesoporous Ta-SiO2 Catalysts Prepared by Non-Hydrolytic Sol-Gel for the Conversion of Ethanol to Butadiene

, Authors: Denis Dochain, Ales Styskalik, Damien Debecker
Version undefined posted 01 October 2019
Posted
Oct 01, 2019
10.26434/chemrxiv.9917000.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Exhaustive Reduction of Esters Enabled by Nickel Catalysis

, Authors: sekar prakash, Adam Cook, yan-long zheng, Stephen Newman
Version undefined posted 01 October 2019
Posted
Oct 01, 2019
10.26434/chemrxiv.9917150.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Asymptotic Behavior of the Exchange-Correlation Energy Density and the Kohn-Sham Potential in Density Functional Theory: Exact Results and Strategy for Approximations

, Authors: Eli Kraisler
Version undefined posted 01 October 2019
Posted
Oct 01, 2019
10.26434/chemrxiv.9917189.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

PEPPI-MS: Strategies to Enhance the Extraction of Electrophoretically Separated Proteins from Polyacrylamide Gels and Their Application to Top-Down/native Mass Spectrometry

, Authors: Ayako Takemori, Lissa C Anderson, Victoria M. Harman, Philip Brownridge, David Butcher, Keisuke Shima, Daisuke Higo, Jun Ishizaki, Hitoshi Hasegawa, Junpei Suzuki, Masakatsu Yamashita, Joseph A. Loo, Rachel R. Ogorzalek Loo, Robert J. Beynon, Nobuaki Takemori
Version undefined posted 01 October 2019
Posted
Oct 01, 2019
10.26434/chemrxiv.9917225.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Utilizing Copper-Mediated Deprotection of Selenazolidine for Cyclic Peptides Synthesis

, Authors: Zhenguang Zhao, Norman Metanis
Version undefined posted 01 October 2019
Posted
Oct 01, 2019
10.26434/chemrxiv.9917519.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Short Syntheses of 1-Substituted Dibenzothiophenes and 3-Substituted Naphthothiophenes

, Authors: Erin N. Welsh, Emily K. Burke, Katherine Roberston, Alex Speed
Version undefined posted 01 October 2019
Posted
Oct 01, 2019
10.26434/chemrxiv.9917969.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Triple Self-Sorting in Constitutional Dynamic Networks: Parallel Generation of Cu(I), Fe(II) and Zn(II) Imine-Based Metal Complexes

, Authors: Jean-François Ayme, Sébastien Dhers, Jean-Marie Lehn
Version undefined posted 01 October 2019
Posted
Oct 01, 2019
10.26434/chemrxiv.9918479.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Simultaneous Generation of a [2×2] Grid-like Complex and a Linear Double Helicate: A Three-Level Self-Sorting Process

, Authors: Jean-François Ayme, Jean-Marie Lehn, Corinne Bailly, Lydia Karmazin
Version undefined posted 01 October 2019
Posted
Oct 01, 2019
10.26434/chemrxiv.9918470.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Highly Selective, Amine-Derived Cannabinoid Receptor 2 Probes

, Authors: Matthias V. Westphal, Roman C. Sarott, Elisabeth A. Zirwes, Anja Osterwald, Wolfgang Guba, Christoph Ullmer, Uwe Grether, Erick M. Carreira
Version undefined posted 01 October 2019
Posted
Oct 01, 2019
10.26434/chemrxiv.9919022.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

A Minimalistic Hydrolase Based on Co-Assembled Cyclic Dipeptides

, Authors: Alexander Kleinsmann, Boris Nachtsheim
Version undefined posted 01 October 2019
Posted
Oct 01, 2019
10.26434/chemrxiv.9919325.v1
by ChemRxiv
 
Subject: Politics and International Relations
,
Working Paper
, Title:

Transparency in Practice in Qualitative Research

, Authors: Diana Kapiszewski, Sebastian Karcher
Version undefined posted 02 October 2019
Posted
Oct 02, 2019
10.33774/apsa-2019-if2he-v2
by APSA Preprints
 
Subject: Chemistry
,
Working Paper
, Title:

Insight into the Mechanisms Driving the Self-Assembly of Functional Interfaces: Moving from Lipids to Charged Amphiphilic Oligomers

, Authors: Azhad U. Chowdhury, Graham J. Taylor, Vera Bocharova, Robert L. Sacci, Yingdong Luo, Ying-Zhong Ma, Stephen A. Sarles, Kunlun Hong, C. Patrick Collier, Benjamin Doughty
Version undefined posted 02 October 2019
Posted
Oct 02, 2019
10.26434/chemrxiv.9922145.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Cycloparaphenylene-Norbornene Monomers Afford Access to Carbon Nanohoop-Based Polymers

, Authors: Ruth Maust, Penghao Li, Lev N. Zakharov, Ramesh Jasti
Version undefined posted 02 October 2019
Posted
Oct 02, 2019
10.26434/chemrxiv.9920504.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Learning to Use the Force: Fitting Repulsive Potentials in Density-Functional Tight-Binding with Gaussian Process Regression

, Authors: Chiara Panosetti, Artur Engelmann, Lydia Nemec, Karsten Reuter, Johannes T. Margraf
Version undefined posted 02 October 2019
Posted
Oct 02, 2019
10.26434/chemrxiv.9922436.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Extracellular Electron Transfer Mediated by a Cytocompatible Redox Polymer Lengthens the Circadian Period of Mammalian Cells

, Authors: Masahito Ishikawa, Kazuki Kawai, Masahiro Kaneko, Kenya Tanaka, Shuji Nakanishi, Katsutoshi Hori
Version undefined posted 02 October 2019
Posted
Oct 02, 2019
10.26434/chemrxiv.9923363.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Sulfur- and Nitrogen-Containing Porous Donor-Acceptor Polymers as Real-Time Optical and Chemical Sensors

, Authors: Yaroslav S. Kochergin, Yu Noda, Ranjit Kulkarni, Klára Škodáková, Ján Tarábek, Johannes Schmidt, Michael J. Bojdys
Version undefined posted 02 October 2019
Posted
Oct 02, 2019
10.26434/chemrxiv.9923642.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

SAMPL6 Octanol-Water Partition Coefficients from Alchemical Free Energy Calculations with MBIS Atomic Charges

, Authors: Maximiliano Riquelme, Esteban Vöhringer-Martinez
Version undefined posted 02 October 2019
Posted
Oct 02, 2019
10.26434/chemrxiv.9924806.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

High Performance Molecular Imaging with MALDI Trapped Ion Mobility Time-of-Flight (timsTOF) Mass Spectrometry

, Authors: Jeffrey Spraggins, Katerina Djambazova, Emilio Rivera, Lukasz Migas, Elizabeth Neumann, Arne Fuetterer, Juergen Suetering, Niels Goedecke, Alice Ly, Raf Van de Plas, Richard Caprioli
Version undefined posted 02 October 2019
Posted
Oct 02, 2019
10.26434/chemrxiv.9210059.v2
by ChemRxiv
 
Subject: Politics and International Relations
,
Working Paper
, Title:

Patterns of interaction between social movements and participatory institutions in the Brazilian policy subsystems

, Authors: Claudia Faria, Luis Henrique Silva
Version undefined posted 02 October 2019
Posted
Oct 02, 2019
10.33774/apsa-2019-gqmj8
by APSA Preprints
 
Subject: Chemistry
,
Working Paper
, Title:

Sequence specificity despite intrinsic disorder: how a disease-associated Val/Met polymorphism rearranges tertiary interactions in a long disordered protein

, Authors: Ruchi Lohia, Reza Salari, Grace Brannigan
Version undefined posted 02 October 2019
Posted
Oct 02, 2019
10.26434/chemrxiv.8135777.v3
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Changing the Static and Dynamic Lattice Effects for the Improvement of the Ionic Transport Properties Within the Argyrodite Li6PS5-xSexI

, Authors: Roman Schlem, Michael Ghidiu, Sean Culver, Anna-Lena Hansen, Wolfgang Zeier
Version undefined posted 02 October 2019
Posted
Oct 02, 2019
10.26434/chemrxiv.9807770.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Tautomeric Equilibrium Revisited: proton-tautomerism in solvent and the fundamentals of molecular stability prediction.

, Authors: Andre Ricardo Carvalho
Version undefined posted 02 October 2019
Posted
Oct 02, 2019
10.26434/chemrxiv.7699952.v3
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Geometric and Energetic Data from Ab Initio Calculations of Haloethene, Haloimine, Halomethylphosphine, Haloiminophosphine, Halodiazene, Halodiphosphene and Halocyclopropane

, Authors: Kridtin Chinsukserm, Wanutcha Lorpaiboon, Peerayar Teeraniramitr, Taweetham Limpanuparb
Version undefined posted 02 October 2019
Posted
Oct 02, 2019
10.26434/chemrxiv.9895874.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Dyson Orbitals within the fc-CVS-EOM-CCSD Framework: Theory and Application to X-ray Photoelectron Spectroscopy of Ground and Excited States

, Authors: Marta L. Vidal, Anna Krylov, Sonia Coriani
Version undefined posted 02 October 2019
Posted
Oct 02, 2019
10.26434/chemrxiv.9616991.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Reductive Cleavage of Secondary Sulfonamides: Converting Terminal Functional Groups into Versatile Synthetic Handles

, Authors: Patrick Fier, Suhong Kim, Kevin M. Maloney
Version undefined posted 03 October 2019
Posted
Oct 03, 2019
10.26434/chemrxiv.9925145.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Synthesis and Evaluation of Cyclic Sulfite Diesters as Sulfur Dioxide (SO2) Donors

, Authors: Satish Malwal, Kundansingh Pardeshi, Harinath Chakrapani
Version undefined posted 03 October 2019
Posted
Oct 03, 2019
10.26434/chemrxiv.9929618.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Rapid Lipolytic Oscillations in Ex-Vivo Adipose Tissue Explants Revealed Through Microfluidic Droplet Sampling at High Temporal Resolution

, Authors: Juan Hu, xiangpeng li, Robert L. Judd, Christopher Easley
Version undefined posted 03 October 2019
Posted
Oct 03, 2019
10.26434/chemrxiv.9927065.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Non-Faradaic Current Suppression in DNA Based Electrochemical Assays with a Differential Potentiostat

, Authors: Mark D. Holtan, Subramaniam Somasundaram, Niamat Khuda, Christopher Easley
Version undefined posted 03 October 2019
Posted
Oct 03, 2019
10.26434/chemrxiv.9929690.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

The Potential Economic Feasibility of Direct Electrochemical Nitrogen Reduction as a Route to Ammonia

, Authors: Gal Hochman, Alan Goldman, Frank A. Felder, James Mayer, Alexander Miller, Patrick L. Holland, Leo Goldman, Pritricia Manocha, Ze Song, Saketh Aleti
Version undefined posted 04 October 2019
Posted
Oct 04, 2019
10.26434/chemrxiv.9894437.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Polymer-Solvent Phase Separation and Criticality in the Formation of Porous Polymeric Solids: A Modeling Study

, Authors: Adam Willard, Paul E. Teichen
Version undefined posted 04 October 2019
Posted
Oct 04, 2019
10.26434/chemrxiv.9881609.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Direct Measurement of Charge Reversal on Lipid Bilayers using Heterodyne-Detected Second Harmonic Generation Spectroscopy

, Authors: HanByul Chang, Paul Ohno, Yangdongling Liu, Emilie Lozier, Naomi Dalchand, Franz Geiger
Version undefined posted 04 October 2019
Posted
Oct 04, 2019
10.26434/chemrxiv.8678450.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Catalytic activation of ethylene C-H bonds on uniform d8 Ir(I) and Ni(II) cations in zeolites: toward molecular level understanding of ethylene polymerization on heterogeneous catalysts

, Authors: Nicholas R. Jaegers, Konstantin Khivantsev, Libor Kovarik, Dan Klaus, Jian Zhi Hu, Yong Wang, János Szanyi
Version undefined posted 04 October 2019
Posted
Oct 04, 2019
10.26434/chemrxiv.8171393.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Stabilization of Super Electrophilic Pd+2 Cations in Small-Pore SSZ-13 Zeolite

, Authors: Konstantin Khivantsev, Nicholas R. Jaegers, Iskra Z. Koleva, Hristiyan A. Aleksandrov, Libor Kovarik, Mark Engelhard, Feng Gao, Yong Wang, Georgi N. Vayssilov, János Szanyi
Version undefined posted 04 October 2019
Posted
Oct 04, 2019
10.26434/chemrxiv.7789454.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Synthesis, Characterization of Immobilized Thiosalicylic-Mercaptoethanol Bi-Ligand System and its Application in Detoxification of Chromium III and Iron III ions from Tannery Wastewater

, Authors: Bulus Habila, Pius Onyeoziri Ukoha, Stanley I.R. Okoduwa, Ahmed Salim, Muazu B. Babangida, Adamu Simon
Version undefined posted 04 October 2019
Posted
Oct 04, 2019
10.26434/chemrxiv.9922211.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Concise Synthesis and Antimicrobial Evaluation of the Guanidinium Alkaloid Batzelladine D

, Authors: You-Chen Lin, Aubert Ribaucourt, Yasamin Moazami, Joshua Pierce
Version undefined posted 04 October 2019
Posted
Oct 04, 2019
10.26434/chemrxiv.9924692.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

3D Texturing of the Water–Air Interface by Biomimetic Self-Assembly

, Authors: Erik Bergendal, Richard A. Campbell, Georgia A. Pilkington, Peter Müller-Buschbaum, Mark W. Rutland
Version undefined posted 04 October 2019
Posted
Oct 04, 2019
10.26434/chemrxiv.9929684.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Photochemically Activated Thiol-Michael Reactions via a Photolatent N-Heterocyclic Carbene

, Authors: Abraham Chemtob, Bao Tram Vu Ngoc, Julien Pinaud, Patrick Lacroix-Desmazes, Valérie Héroguez
Version undefined posted 04 October 2019
Posted
Oct 04, 2019
10.26434/chemrxiv.9930014.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Gas-Phase Bioproduction of a High-Value-Added Monoterpenoid (E)-Geranic Acid by Metabolically Engineered Acinetobacter Sp. Tol 5

, Authors: Atsushi Usami, Masahito Ishikawa, Katsutoshi Hori
Version undefined posted 04 October 2019
Posted
Oct 04, 2019
10.26434/chemrxiv.9932366.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Synthesis and Styrene Copolymerization of Novel Halogen, Alkoxy, and Alkyl Ring-Disubstituted Isopropyl 2-Cyano-3-Phenyl-2-Propenoates

, Authors: Kumail M. Hussain, Rachel M. Breault, Noreen J. Caporusso, Cathleen J. Cu, Kyle J. Decker, Tara K. Gill, Emily K. Gray, Christopher J. Homsi, Melina F. Kanji, Rachel M. Stone, Jose L. Zepeda, Sara M. Rocus, William S. Schjerven, Gregory Kharas
Version undefined posted 04 October 2019
Posted
Oct 04, 2019
10.26434/chemrxiv.9932393.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Polymerization-Induced Emission

, Authors: Bin Liu, Haoke Zhang, shunjie liu, JingZhi Sun, Xing-Hong Zhang, Ben Zhong Tang
Version undefined posted 07 October 2019
Posted
Oct 07, 2019
10.26434/chemrxiv.9933170.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Primary Alcohols via Nickel Pentacarboxycyclopentadienyl Diamide–Catalyzed Hydrosilylation of Terminal Epoxides

, Authors: Keri Steiniger, Tristan Lambert
Version undefined posted 07 October 2019
Posted
Oct 07, 2019
10.26434/chemrxiv.9936389.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Importance of Model Size in Quantum Mechanical Studies of DNA Intercalation

, Authors: Drew P. Harding, Laura J. Kingsley, Glen Spraggon, Steven Wheeler
Version undefined posted 07 October 2019
Posted
Oct 07, 2019
10.26434/chemrxiv.9936473.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Visualizing Chemical Dynamics in an Ionic Liquid Microdroplet using Ultrafast 2D IR Microscopy

, Authors: Kathryn M. Tracy, Biswajit Guchhait, clara tibbetts, Bradley M. Luther, Amber Krummel
Version undefined posted 07 October 2019
Posted
Oct 07, 2019
10.26434/chemrxiv.9936464.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

How DNA Base Pairs Escape From the Excited-State: Antiaromaticity Relief in the Picoseconds

, Authors: Lucas Karas, Chia-Hua Wu, Henrik Ottosson, Judy Wu
Version undefined posted 07 October 2019
Posted
Oct 07, 2019
10.26434/chemrxiv.9936614.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

A Long π-Conjugated Poly-para-Phenylene-Based Polymeric Segment of Single-Walled Carbon Nanotubes

, Authors: Qiang Huang, Mengmeng Zhang, Jinyi Wang, Shengda Wang, Yayu Wu, Shangfeng Yang, Pingwu Du
Version undefined posted 07 October 2019
Posted
Oct 07, 2019
10.26434/chemrxiv.9936995.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Kinetic Isotope Effect on Electron Transfer Rates Across Self-Assembled Monolayers: A Case for Quantum Effects

, Authors: Samir Chattopadhyay, Sabyasanchi Bandyopadhyay, Abhishek Dey
Version undefined posted 07 October 2019
Posted
Oct 07, 2019
10.26434/chemrxiv.9937256.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

The Lazy Life of Lipid-Linked Oligosaccharides in All Life Domains

, Authors: Pablo Ricardo Arantes, Conrado Pedebos, Marcelo D. Poleto, Laércio Pol-Fachin, Hugo Verli
Version undefined posted 07 October 2019
Posted
Oct 07, 2019
10.26434/chemrxiv.8170367.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Divalent Cobalt and Copper Coordination Complexes of κ2-N, O-Derivatives of (Z)-1-R-2-(2’-oxazolin-2’-yl)-eth-1-en-1-ates: Structure and Reactivity Patterns

, Authors: Kathleen L. May, Sanja Resanović, Maja W. Chojnacka, Khrystyna Herasymchuk, Douglas G. Vaughan, Jianfeng Zhu, J. Wilson Quail, Alan J. Lough, Robert Gossage
Version undefined posted 07 October 2019
Posted
Oct 07, 2019
10.26434/chemrxiv.9929885.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

A Solvent Free Synthetic Route for Cerium(IV) Metal-Organic Frame-works with UiO-66 Architecture and Their Photocatalytic Application

, Authors: Matteo Campanelli, Tiziana Del Giacco, Filippo De Angelis, Edoardo Mosconi, Marco Taddei, Fabio Marmottini, Ferdinando Costantino
Version undefined posted 07 October 2019
Posted
Oct 07, 2019
10.26434/chemrxiv.9199634.v2
by ChemRxiv
 
Subject: Politics and International Relations
,
Presentation
, Title:

"Would I Do This All Over Again? Mid-Career Voices in Political Science"

, Authors: Laura van Assendelft, Page Fortna, Claudine Gay, Kira Sanbonmatsu
Version undefined posted 08 October 2019
Posted
Oct 08, 2019
10.33774/apsa-2019-76m98-v2
by APSA Preprints
 
Subject: Chemistry
,
Working Paper
, Title:

Reductive Electrophotocatalysis: Merging Electricity and Light to Achieve Extreme Reduction Potentials

, Authors: Hyunwoo Kim, Hyungjun Kim, Tristan Lambert, Song Lin
Version undefined posted 08 October 2019
Posted
Oct 08, 2019
10.26434/chemrxiv.9936623.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Defect Chemistry of Disordered Solid-State Electrolyte Li10GeP2S12

, Authors: Prashun Gorai, Hai Long, Eric Jones, Shriram Santhanagopalan, Vladan Stevanovic
Version undefined posted 08 October 2019
Posted
Oct 08, 2019
10.26434/chemrxiv.9942380.v1
by ChemRxiv
 
Subject: Politics and International Relations
,
Working Paper
, Title:

Anger, Agency and Action in Black and White: Racial Efficacy, Emotion & Political Behavior

, Authors: Davin Phoenix, Nathan Chan
Version undefined posted 09 October 2019
Posted
Oct 09, 2019
10.33774/apsa-2019-lct98
by APSA Preprints
 
Subject: Politics and International Relations
,
Working Paper
, Title:

Gender, Campaign Contributions, and State Intermediate Appellate Court Elections

, Authors: Andrew Smith, Conny Kazungu
Version undefined posted 09 October 2019
Posted
Oct 09, 2019
10.33774/apsa-2019-85hqt
by APSA Preprints
 
Subject: Chemistry
,
Working Paper
, Title:

Transient Supramolecular Assembly by Programmable pH Cycles

, Authors: Guido Panzarasa, Alexandre L. Torzynski, Tianqi Sai, Katrina Smith-Mannschott, Eric R. Dufresne
Version undefined posted 09 October 2019
Posted
Oct 09, 2019
10.26434/chemrxiv.9938105.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Use of compound specific δ¹³C stable isotope analysis for intact triacylglycerides using high temperature gas chromatography up to 430°C

, Authors: Paul Sutton, Mario Tuthorn, Jason Newton
Version undefined posted 09 October 2019
Posted
Oct 09, 2019
10.26434/chemrxiv.9933236.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Modelling the Hydrolysis of Iron-Sulfur Clusters

, Authors: Murilo H. Teixeira, Felipe Curtolo, Sofia R. G. Camilo, Martin J. Field, Peng Zheng, Hongbin Li, Guilherme M. Arantes
Version undefined posted 09 October 2019
Posted
Oct 09, 2019
10.26434/chemrxiv.9938939.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Diastereo- and Enantioselective CuH-Catalyzed Hydroamination of Strained Trisubstituted Alkenes

, Authors: Sheng Feng, Hua Hao, Peng Liu, Stephen L. Buchwald
Version undefined posted 09 October 2019
Posted
Oct 09, 2019
10.26434/chemrxiv.9941723.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Towards Efficient Generation, Correction and Properties Control of Unique Drug-like Structures

, Authors: Maksym Druchok, Dzvenymyra Yarish, Oleksandr Gurbych, Mykola Maksymenko
Version undefined posted 09 October 2019
Posted
Oct 09, 2019
10.26434/chemrxiv.9941858.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

A Novel Aza-Nazarov Cyclization of Quinazolinonyl Enones: A Facile Access to CRing Substituted Vasicinones and Luotonins

, Authors: Sivappa Rasapalli, Vamshisammeta Reddy Sammeta, Zachary F Murphy, Yanchang Huang, Jeffrey A Boerth, James A Golen, Sergey N Savinov
Version undefined posted 09 October 2019
Posted
Oct 09, 2019
10.26434/chemrxiv.9941867.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Tyrosinase-Mediated Oxidative Coupling of Tyrosine Tags on Peptides and Proteins

, Authors: Alan Marmelstein, Marco Lobba, Casey S. Mogilevsky, Johnathan Maza, Daniel D. Brauer, Matthew Francis
Version undefined posted 09 October 2019
Posted
Oct 09, 2019
10.26434/chemrxiv.9942038.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Sensitive Mechanocontrolled Luminescence in Cross-Linked Polymer Films

, Authors: Ayumu Karimata, Pradnya Patil, Eugene Khaskin, Sébastien Lapointe, Robert R. Fayzullin, Pavlos Stampoulis, Julia Khusnutdinova
Version undefined posted 10 October 2019
Posted
Oct 10, 2019
10.26434/chemrxiv.9943943.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Molecular Origin of Positive and Negative Electromechanical Response in Hydrogen-Bonded Systems

, Authors: Keith Werling, Daniel Lambrecht, Geoffrey Hutchison
Version undefined posted 10 October 2019
Posted
Oct 10, 2019
10.26434/chemrxiv.9943640.v1
by ChemRxiv
 
Subject: Politics and International Relations
,
Working Paper
, Title:

Four Arenas: Malaysia’s 2018 Election, Reform, and Democratization

, Authors: Kai Ostwald, Steven Oliver
Version undefined posted 10 October 2019
Posted
Oct 10, 2019
10.33774/apsa-2019-6lprv
by APSA Preprints
 
Subject: Chemistry
,
Working Paper
, Title:

Structure-Based Design of Nucleoside-Derived Analogues as Sulfotransferase Inhibitors

, Authors: Neil Kershaw, Dominic Byrne, Hollie Parsons, Neil G Berry, David Fernig, Patrick A. Eyers, Richard Cosstick
Version undefined posted 11 October 2019
Posted
Oct 11, 2019
10.26434/chemrxiv.9944243.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Stereospecific Synthesis and Photophysical Properties of Propeller-Shaped C90H48 PAH

, Authors: Fangyuan Zhang, Evripidis Michail, Fridolin Saal, Ana-Maria Krause, Prince Ravat
Version undefined posted 11 October 2019
Posted
Oct 11, 2019
10.26434/chemrxiv.9944906.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Electrochemical Synthesis of Sulfinic Esters from Alcohols and Thiophenols

, Authors: Yang He, Yu Wei, Liang Xu
Version undefined posted 11 October 2019
Posted
Oct 11, 2019
10.26434/chemrxiv.9945083.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Interlayer Engineering of Flexible and Large Area Red Organic Light Emitting Diodes Based on a N-Annulated Perylene Diimide Dimer

, Authors: Mohammad Rahmati, Majid Pahlevani, Gregory Welch
Version undefined posted 11 October 2019
Posted
Oct 11, 2019
10.26434/chemrxiv.9946931.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

N-Heterocyclic Carbene-Catalyzed Synthesis of Ynones via C–H Alkynylation of Aldehydes with Alkynyliodonium Salts

, Authors: Adam A. Rajkiewicz, Natalia Wojciechowska, Marcin Kalek
Version undefined posted 11 October 2019
Posted
Oct 11, 2019
10.26434/chemrxiv.9946925.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Probing the Versatility of Shape-Persistent Tetraphenylmethane Dendrimers by Modification of the Skeleton

, Authors: Julio Ignacio Urzúa, Sandra Campana, Massimo Lazzari, Mercedes Torneiro
Version undefined posted 11 October 2019
Posted
Oct 11, 2019
10.26434/chemrxiv.9947054.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Density Driven Correlations in Ensemble Density Functional Theory: Insights from Simple Excitations in Atoms

, Authors: Tim Gould, Stefano Pittalis
Version undefined posted 11 October 2019
Posted
Oct 11, 2019
10.26434/chemrxiv.9947249.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Fc-Binding Antibody-Recruiting Molecules for Cancer Therapy: Exploiting Endogenous IgG Without antigen–Fab Interactions

, Authors: Koichi Sasaki, Minori Harada, Yoshiki Miyashita, Hiroshi Tagawa, Akihiro Kishimura, Takeshi Mori, Yoshiki Katayama
Version undefined posted 11 October 2019
Posted
Oct 11, 2019
10.26434/chemrxiv.9761633.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

(4+3)-Cycloaddition of Donor-Acceptor Cyclopropanes with Thiochalcones: A Diastereoselective Access to Tetrahydrothiepines

, Authors: André U. Augustin, J. Luca Merz, Peter G. Jones, Grzegorz Mloston, Daniel Werz
Version undefined posted 11 October 2019
Posted
Oct 11, 2019
10.26434/chemrxiv.9955202.v1
by ChemRxiv
 
Subject: Chemistry
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Working Paper
, Title:

Method for Absolute Quantification of Short Chain Fatty Acids via Reverse Phase Chromatography Mass Spectrometry

, Authors: Dominique Bihan, - Thomas Rydzak, Madeleine Wyss, Keir Pittman, Kathy D. McCoy, Ian A. Lewis
Version undefined posted 11 October 2019
Posted
Oct 11, 2019
10.26434/chemrxiv.9955553.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Modelling Flexible Protein-Ligand Binding in p38α MAP Kinase using the QUBE Force Field

, Authors: Joshua Horton, Alice Allen, Daniel Cole
Version undefined posted 11 October 2019
Posted
Oct 11, 2019
10.26434/chemrxiv.9956201.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Elucidating the Molecular Basis of Avibactam Mediated Inhibition of Class A β-Lactamases

, Authors: Chandan Kumar Das, Nisanth N. Nair
Version undefined posted 11 October 2019
Posted
Oct 11, 2019
10.26434/chemrxiv.9956069.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Total Synthesis of (S,S)-Tetramethylmagnolamine via Aerobic Desymmetrization

, Authors: Zheng Huang, Xiang Ji, Jean-Philip Lumb
Version undefined posted 11 October 2019
Posted
Oct 11, 2019
10.26434/chemrxiv.9956213.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Shape-Controlled, Single-Crystal Gold Surface Nanostructures

, Authors: Sasan V. Grayli, Xin Zhang, Dmitry Star, Gary Leach
Version undefined posted 11 October 2019
Posted
Oct 11, 2019
10.26434/chemrxiv.9956450.v1
by ChemRxiv
 
Subject: Chemistry
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Working Paper
, Title:

Deep Generative Model for Sparse Graphs using Text-Based Learning with Augmentation in Generative Examination Networks

, Authors: Ruud van Deursen, Guillaume Godin
Version undefined posted 11 October 2019
Posted
Oct 11, 2019
10.26434/chemrxiv.9901070.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Accurate Electromechanical Characterization of Soft Molecular Monolayers using Piezo Force Microscopy

, Authors: Nathaniel Miller, Haley Grimm, Seth Horne, Geoffrey Hutchison
Version undefined posted 11 October 2019
Posted
Oct 11, 2019
10.26434/chemrxiv.8199263.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Two Are Better than One: A Design Principle for Ultralong Persistent Luminescence of Pure Organics

, Authors: Parvej Alam, Nelson Leung, Junkai Liu, Xuepeng Zhang, Zikai He, Ryan Tsz Kin Kwok, Jacky W. Y. Lam, Herman H.-Y. Sung, Ian Duncan Williams, Qian Peng, Ben Zhong Tang
Version undefined posted 11 October 2019
Posted
Oct 11, 2019
10.26434/chemrxiv.8298839.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Photophysical Investigation of 8-amino 2-Naphthol in Different Micellar Environment

, Authors: Neetu Pandey, Richa Gahlaut, Pramod Pandey, Priyanka Arora, Kalpana Tiwari, Neeraj K. Joshi, Hem C. Joshi, Sanjay Pant
Version undefined posted 11 October 2019
Posted
Oct 11, 2019
10.26434/chemrxiv.9942680.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Metal-Free Click Synthesis of Functional 1-Substituted-1,2,3-Triazoles

, Authors: Marie-Claire Giel, Christopher J. Smedley, Emily R. R. Mackie, Taijie Guo, Jiajia Dong, Tatiana P. Soares da Costa, John E. Moses
Version undefined posted 15 October 2019
Posted
Oct 15, 2019
10.26434/chemrxiv.9937754.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Clustering-Triggered Efficient Room Temperature Phosphorescence from Nonconventional Luminophores

, Authors: Shuyuan Zheng, Taiping Hu, Xin Bin, Yunzhong Wang, Yuanping Yi, Yongming Zhang, Wang Zhang Yuan
Version undefined posted 15 October 2019
Posted
Oct 15, 2019
10.26434/chemrxiv.9959132.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Application of In Situ X-ray Absorption Spectroscopy to Study Dilute Chromium Ions in a Molten Chloride Salt

, Authors: Jisue Moon, Carter Abney, Dmitriy Dolzhnikov, James M. Kurley, Kevin A. Beyer, Joshua Wright, Sheng Dai, Richard T. Mayes, Stephen S. Raiman
Version undefined posted 15 October 2019
Posted
Oct 15, 2019
10.26434/chemrxiv.9959807.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Tuning Second Coordination Sphere Interactions in Polypyridyl–Iron Complexes to Achieve Selective Electrocatalytic Reduction of Carbon Dioxide to Carbon Monoxide

, Authors: David Zee, Michael Nippe, Amanda King, Christopher Chang, Jeffrey R. Long
Version undefined posted 15 October 2019
Posted
Oct 15, 2019
10.26434/chemrxiv.9961664.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

The Sensitivity of Cu for Electrochemical Carbon Dioxide Reduction to Hydrocarbons as Revealed by High Throughput Experiments

, Authors: Yunchieh Lai, Ryan J. R. Jones, Yu Wang, Lan Zhou, Matthias Richter, John Gregoire
Version undefined posted 15 October 2019
Posted
Oct 15, 2019
10.26434/chemrxiv.9961718.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Intermolecular 3+3 Ring Expansion of Aziridines to Dehydropiperidines through the Intermediacy of Aziridinium Ylides

, Authors: Jennifer Schomaker, Josephine Eshon, Kate A. Nicastri, Steven C. Schmid, William T. Raskopf, Ilia A. Guzei,, Israel Fernández
Version undefined posted 15 October 2019
Posted
Oct 15, 2019
10.26434/chemrxiv.9961937.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Compression of Spin-Adapted Multi-Configurational Wave Functions in Exchange-Coupled Polynuclear Spin Systems

, Authors: Giovanni Li Manni, Werner Dobrautz, Ali Alavi
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9962000.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Extended Interfacial Stability Through Simple Acid Rinsing in a Li-Rich Oxide Cathode Material

, Authors: Srinivasan Ramakrishnan, Byungchun Park, Jue Wu, Wanli Yang, Bryan D. McCloskey
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9962471.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Remote Regioselective Electrophilic Aromatic Substitutions Using a Tetrafluoropyridyl (TFP) Phenol Protecting Group

, Authors: William Brittain, Steven Cobb
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9963293.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Hypoxia-Activated Pro-Drugs of the KDAC Inhibitor Vorinostat (SAHA)

, Authors: Ewen D. D. Calder, Anna Skwarska, Ishna N. Mistry, Deborah Sneddon, Stuart Conway, Ester M. Hammond
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9963503.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Evolution of N-Heterocycle-substituted Iodoarenes (NHIAs) to efficient Organocatalysts in Iodine(I/III)-mediated Oxidative Transformations

, Authors: Andreas Boelke, Boris Nachtsheim
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9963494.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

An Activity-Based Methionine Bioconjugation Approach to Developing Proximity-Activated Imaging Reporters

, Authors: Jun Ohata, Lakshmi Krishnamoorthy, Monica Gonzalez, Tong Xiao, Diana Iovan, F. Dean Toste, Evan Miller, Christopher Chang
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9964256.v1
by ChemRxiv
 
Subject: Chemistry
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Working Paper
, Title:

Monolithic Solder-on Nanoporous Si-Cu Contacts for Stretchable Silicone Composite Sensors

, Authors: Guder Research, Estefania Nunez-Bajo, Max Grell, Yasin Cotur, Giandrin Barandun, Ji-Seon Kim, Firat Güder
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9963989.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Impact of Dehydroamino Acids on the Structure and Stability of Incipient 3₁₀ Helical Peptides

, Authors: Daniel Joaquin, Michael A. Lee, David W. Kastner, Jatinder Singh, Shardon T. Morrill, Gracie Damstedt, Steven Castle
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9968375.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

On the Relative Stability of Near-Surface Oxygen Vacancies at the CeO2(111) Surface upon Zr Doping

, Authors: G. S. Otero, Pablo Lustemberg, Fernando D. Prado, M. V. Ganduglia-Pirovano
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9962039.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Influence of Amylose Size on the Structure and NMR Spectrum of Amylose-Palmitic Acid Complexes. Insight from Classical Molecular Dynamics Simulations and DFT Quantum Chemical Computations.

, Authors: Adrien Schahl, Valérie Réat, franck jolibois
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9970622.v1
by ChemRxiv
 
Subject: Chemistry
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Working Paper
, Title:

Autonomous Discovery of Materials for Intercalation Electrodes

, Authors: Felix Tim Bölle, Nicolai Rask Mathiesen, Alexander Juul Nielsen, Tejs Vegge, Juan Maria García Lastra, Ivano E. Castelli
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9971054.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

An Autonomous Electrochemical Test stand for Machine Learning Informed Electrolyte Optimization

, Authors: Jay Whitacre, Jared Mitchell, Adarsh Dave, Sven Burke, Venkatasubramanian Viswanathan
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9971741.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Electrochemical Reduction of Homo– and Hetero–tri(aryl)borohydrides

, Authors: Robin Blagg, Elliot Lawrence, Gregory Wildgoose
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9974246.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Functional Polyselenoureas for Selective Gold Recovery Prepared from Catalyst-Free Multicomponent Polymerizations of Elemental Selenium

, Authors: Xiuying Wu, Hua Lin, Fengying Dai, Rongrong Hu, Ben Zhong Tang
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9974354.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Electrochemical Vicinal Difluorination of Alkenes: Sustainable, Scalable, and Amenable to Electron-rich Substrates

, Authors: Sayad Doobary, Alexi Sedikides, Henry caldora, Darren poole, Alastair Lennox
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9974687.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Elucidating the Drug Release from Metal-Organic Framework Nanocomposites via in Situ Synchrotron Microspectroscopy and Theoretical Modelling

, Authors: Barbara Souza, Lorenzo Dona, Kirill Titov, Paolo Bruzzese, Zhixin Zeng, Yang Zhang, Arun Babal, Annika Moslein, Mark Frogley, Magda Wolna, Gianfelice Cinque, Bartolomeo Civalleri, Jin-Chong Tan
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9975389.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

A Bond Charge Model Ansatz for Intrinsic Bond Energies: Application to C-C Bonds

, Authors: Rubén Laplaza, Victor Polo, Julia Contreras-García
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9975992.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Liposomal Chitosan-N-Acetyl Cysteine Nanoparticle for In-Vitro/In-Vivo Near Infrared Fluorescent (NIR) Imaging

, Authors: Piyush Kumar, Timothy Van Treuren, Amalendu Ranjan, Jamboor K Vishwanatha
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9976145.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Dysprosiacarboranes: A New Type of Organometallic Single-Molecule Magnets

, Authors: Peng-Bo Jin, Yuan-Qi Zhai, Ke-Xin Yu, Richard E. P. Winpenny, Yan-Zhen Zheng
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9976133.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Determining the Role of Oxygen Vacancies in the Photocatalytic Performance of WO3 for Water Oxidation

, Authors: Sacha Corby, Laia Francàs, Andreas Kafizas, James R Durrant
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9976832.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Assessment of Dynamic Structural Instabilities Across 24 Cubic Inorganic Halide Perovskites

, Authors: Ruo Xi Yang, Jonathan Skelton, E Lora Da Silva, Jarvist Moore Frost, Aron Walsh
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9976868.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Understanding Attenuated Solvent Reorganization Energies near Electrode Interfaces

, Authors: Aditya Limaye, Wendu Ding, Adam Willard
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9978593.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Development of Small-Scale Experiments for the Education of Chemical Engineering and Its Practice for Undergraduates

, Authors: Kenji Katayama, Risa Ichinohe, Yuki Konno, Woon Yong Sohn, Shota Kuwahara, Toshitaka Funazukuri
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9947474.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

A GPU-Accelerated Machine Learning Framework for Molecular Simulation: HOOMD-blue with TensorFlow

, Authors: Rainier Barrett, Maghesree Chakraborty, Dilnoza Amirkulova, Heta Gandhi, Andrew White
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.8019527.v3
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Observation of dissipative chlorophyll-to-carotenoid energy transfer in light-harvesting complex II in membrane nanodiscs

, Authors: Minjung Son, Alberta Pinnola, Samuel C. Gordon, Roberto Bassi, Gabriela S. Schlau-Cohen
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.8156702.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Carbon Dot Sensitized Photoanodes for Visible Light Driven Organic Transformations

, Authors: Francisco Yarur, John Manioudakis, Rafik Naccache, Marek Majewski
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9942986.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Light-Activated Rhenium Complexes with Dual Mode of Action against Bacteria

, Authors: Angelo Frei, Maite Amado, Matthew Cooper, Mark A. T. Blaskovich
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9900875.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Site-Specific Generation of Protein-Protein Conjugates Using Native Amino Acids

, Authors: Marco Lobba, Christof Fellmann, Alan Marmelstein, Johnathan Maza, Elijah Kissman, Stephanie A. Robinson, Brett T. Staahl, Cole Urnes, Rachel J. Lew, Jennifer A. Doudna, Matthew Francis, Casey S. Mogilevsky
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9941948.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

From Desktop to Benchtop – A Paradigm Shift in Asymmetric Synthesis

, Authors: Mihai Burai Patrascu, Joshua Pottel, Sharon Pinus, Michelle Bezanson, Per-Ola Norrby, Nicolas Moitessier
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9758558.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Copper Reactivity Can be Tuned to Catalyse the Stereoselective Synthesis of 2-Deoxy Glycosides from Glycals

, Authors: Carlos Palo-Nieto, Abhijit Sau, Robin Jeanneret, Pierre-Adrien Payard, Maristela Braga Martins-Teixeira, Ivone Carvalho, Laurence Grimaud, M. Carmen Galan
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9272684.v3
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Virtual Excited State Reference for the Discovery of Electronic Materials Database (VERDE Materials DB): An Open-Access Resource for Ground and Excited State Properties of Organic Molecules

, Authors: Biruk Abreha, Snigdha Agarwal, Ian Foster, Ben Blaiszik, Steven Lopez
Version undefined posted 16 October 2019
Posted
Oct 16, 2019
10.26434/chemrxiv.9767978.v2
by ChemRxiv
 
Subject: Politics and International Relations
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Working Paper
, Title:

Understanding Latin American anti-populism

, Authors: Eduardo Enríquez Arévalo
Version undefined posted 18 October 2019
Posted
Oct 18, 2019
10.33774/apsa-2019-kttcq
by APSA Preprints
 
Subject: Politics and International Relations
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Working Paper
, Title:

Does Transparency Inhibit Political Compromise?

, Authors: Jeffrey Harden, Justin Kirkland
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.33774/apsa-2019-tdw2r
by APSA Preprints
 
Subject: Politics and International Relations
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Working Paper
, Title:

Do Popular Norms Matter for Democratic Backsliding?

, Authors: Dean Schafer
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.33774/apsa-2019-45m69
by APSA Preprints
 
Subject: Chemistry
,
Working Paper
, Title:

High Resolution Photoelectron Spectroscopy of Cryogenically-Cooled NO3ˉ

, Authors: Mark Babin, Jessalyn DeVine, John F. Stanton, Daniel Neumark, Martin DeWitt
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9974699.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

In-Situ Formation of H-Bonding Imidazole Chains in Break-Junction Experiments

, Authors: Chuanli Wu, Aminah Alqahtani, Sara Sangtarash, Andrea Vezzoli, Hatef Sadeghi, Craig M. Robertson, Chenxin Cai, Colin Lambert, Simon Higgins, Richard Nichols
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9976913.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Transformer-CNN: Fast and Reliable Tool for QSAR

, Authors: Pavel Karpov, Guillaume Godin, Igor Tetko
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9961787.v1
by ChemRxiv
 
Subject: Chemistry
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Working Paper
, Title:

Synthesis of Phospho-Amino Acid Analogues as Tissue Adhesive Cement Additives

, Authors: Christopher Spicer, Michael Pujari-Palmer, Hélène Autefage, Gerard Insley, Philip Procter, Håkan Engqvist, Molly Stevens
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9980825.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Tools to Quantify Molecular Transport: Electroosmosis Dominates Electrophoresis of Fluoroquinolones Across the Outer Membrane Porin F (OmpF)

, Authors: Jayesh Arun Bafna, Sushil Pangeni, Mathias Winterhalter, M. Alphan Aksoyoglu
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9981242.v1
by ChemRxiv
 
Subject: Politics and International Relations
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Working Paper
, Title:

Understanding and Confronting Barriers to Youth Voting in America

, Authors: Jared McDonald, Michael Hanmer
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.33774/apsa-2019-42qw1
by APSA Preprints
 
Subject: Chemistry
,
Working Paper
, Title:

Encapsulation of a Ruthenium(II) Complex in Polylactide Nanoparticles: A Route to Remarkable Cellular Uptake for Photodynamic Therapy of Cancer

, Authors: Nancy Soliman, Luke K. McKenzie, Johannes Karges, Emilie Bertrand, Mickaël Tharaud, Marta Jakubaszek, Vincent Guérineau, Bruno Goud, Marcel Hollenstein, Gilles Gasser, Christophe M. Thomas
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9981500.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

A Structure-Based Platform for Predicting Chemical Reactivity

, Authors: Frederik Sandfort, Felix Strieth-Kalthoff, Marius Kühnemund, Christian Beecks, Frank Glorius
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9981488.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

GRAM: A True Null Model for Relative Binding Affinity Predictions

, Authors: Guanglei Cui, Alan P. Graves, Eric S. Manas
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9956474.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Structure-Property Relationships in Unsymmetric Bis(antiaromatics): Who Wins the Battle Between Pentalene and Benzocyclobutadiene?

, Authors: Péter J. Mayer, Ouissam El Bakouri, Tamás Holczbauer, Gergely F. Samu, Csaba Janáky, Henrik Ottosson, Gábor London
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9981806.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Reticular Growth of Graphene Nanoribbon 2D Covalent Organic Frameworks

, Authors: Gregory Veber, Christian S. Diercks, Cameron Rogers, Wade S. Perkins, Jim Ciston, Alex Liebman-Peláez, Chenhui Zhu, Felix R. Fischer
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9985118.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Origins of Negative and Positive Electromechanical Response of Oligopeptide Piezoelectrics

, Authors: Ni Nyoman D. Gayatri, Geoffrey Hutchison
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9985205.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

The Dynamic Ligand Field of a Molecular Qubit: Decoherence Through Spin–Phonon Coupling

, Authors: Ruben Mirzoyan, Ryan Hadt
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9985124.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

α-Glucuronosyl and α-Glucosyl Diacylglycerides, Natural Killer T Cell-Activating Lipids from Bacteria and Fungi

, Authors: SATVIKA BURUGUPALLI, CATARINA DOS SANTOS SA E ALMEIDA, Dylan GM Smith, SAYALI SHAH, ONISHA PATEL, Jamie Rossjohn, ADAM ULDRICH, DALE GODFREY, Spencer Williams
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9746033.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Photocontrolled Radical Polymerization from Hydridic C–H Bonds

, Authors: Erin Stache, Veronika Kottisch, Brett Fors
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9985496.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

The Catalytic Acid-Base in GH109 Resides in a Conserved GGHGG Loop and Allows for Comparable α-Retaining and β-Inverting Activity in an N-Acetylgalactosaminidase from Akkermansia Muciniphila

, Authors: David Teze, Bashar Shuoker, Evan Kirk Chaberski, Ruth Sonja Kunstmann, Folmer Fredslund, Günther H.J. Peters, Eva Nordberg Karlsson, Ditte Hededam Welner, Maher Abou Hachem
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9989102.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Cancer Cells Possess Different Isotopic Enrichment

, Authors: Reginald Little, Orit Uziel
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9989711.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Tropoelastin-Inspired, Non-Ionic, Self-Coacervating Polyesters as Strong Underwater Adhesives

, Authors: Amal Narayanan, Joshua Menefee, Qianhui Liu, Ali Dhinojwala, Abraham Joy
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9991937.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

HIV Capsid Inhibitor Capacity of Different Isomers of Di-Pyridine Benzene and Its Alkyl and Halide Derivatives

, Authors: Nilanjana Biswas, Sangita Ghosh, Arijit Bag
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9992081.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Probing the Inverse Trans Influence in Americium and Lanthanide Tribromide Tris(tricyclohexylphosphine oxide)

, Authors: Cory Windorff, Cristian Celis-Barros, Joseph Sperling, Noah Mckinnon, Thomas Albrecht-Schmitt
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9992402.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Predicting Retrosynthetic Pathways Using a Combined Linguistic Model and Hyper-Graph Exploration Strategy

, Authors: Philippe Schwaller, Riccardo Petraglia, Valerio Zullo, Vishnu H Nair, Rico Andreas Haeuselmann, Riccardo Pisoni, Costas Bekas, Anna Iuliano, Teodoro Laino
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9992489.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Minimum Mode Saddle Point Searches Using Gaussian Process Regression with Inverse-Distance Covariance Function

, Authors: Olli-Pekka Koistinen, Vilhjálmur Ásgeirsson, Aki Vehtari, Hannes Jónsson
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9994868.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Real-Time in situ Observations Reveal a Double Role for Ascorbic Acid in the Anisotropic Growth of Silver on Gold

, Authors: Kinanti Aliyah, Jieli Lyu, Claire Goldmann, Thomas Bizien, Cyrille Hamon, Damien Alloyeau, Doru Constantin
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9994940.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Linear Correlation Models for the Redox Potential of Organic Molecules in Aqueous Solutions

, Authors: Jessica C. Ortiz-Rodríguez, Juan A. Santana, Dalvin D Méndez-Hernández
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9996155.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Microsecond Timescale Simulations at the Transition State of PmHMGR Predict Remote Allosteric Residues

, Authors: Taylor Quinn, Calvin N. Steussy, Brandon E. Haines, Jinping Lei, Wei Wang, Fu Kit Sheong, Cynthia V. Stauffacher, Xuhui Huang, Per-Ola Norrby, Paul Helquist, Olaf Wiest
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9999545.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Theoretical Examination of Efficiency of Anthocyanidins as Sensitizers in Dye-Sensitized Solar Cells

, Authors: Ibrahim Olasegun Abdulsalami, Banjo Semire, Issa Adewale Bello
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9999548.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Overcoming Crystallinity Limitations of Aluminium Metal–Organic Frameworks by Oxalic Acid Modulated Synthesis

, Authors: Stefano Canossa, Adrian Gonzalez-Nelson, Leonid Shupletsov, María del Carmen Martín, Monique van der Veen
Version undefined posted 21 October 2019
Posted
Oct 21, 2019
10.26434/chemrxiv.9999572.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Computational Screening of Transition Metal /p-block Hybrid Electrocatalysts for CO2 Reduction

, Authors: Sahithi Ananthaneni, Rees Rankin
Version undefined posted 22 October 2019
Posted
Oct 22, 2019
10.26434/chemrxiv.9999656.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Extraction on Paper, an Active Learning Technique to Facilitate Student Understanding of Liquid-Liquid Extraction

, Authors: Kate J. McKnelly, William J. Howitz, Simon Lam, Renee Link
Version undefined posted 22 October 2019
Posted
Oct 22, 2019
10.26434/chemrxiv.9999734.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Terbium(III) Phthalocyaninato Multiple-Decker Complexes in High Oxidation States: Correlation Between Electronic, Structural and Magnetic Properties and Unexpected Triplet Biradical States

, Authors: Yoji Horii, Marko Damjanović, M. R. Ajayakumar, Keiichi Katoh, Yasutaka Kitagawa, Liviu Chibotaru, Liviu Ungur, Marta Mas-Torrent, Wolfgang Wernsdorfer, Markus Enders, Jaume Veciana, Masahiro Yamashita
Version undefined posted 22 October 2019
Posted
Oct 22, 2019
10.26434/chemrxiv.9999848.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Rational Design of Quasi Zero-Strain NCM Cathode Materials for Minimizing Volume Change Effects in All-Solid-State Batteries

, Authors: Florian Strauss, Lea de Biasi, A-Young Kim, Jonas Hertle, Simon Schweidler, Juergen Janek, Pascal Hartmann, Torsten Brezesinski
Version undefined posted 22 October 2019
Posted
Oct 22, 2019
10.26434/chemrxiv.10000751.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Chance Emergence of Catalytic Activity and Promiscuity in a Self-Replicator

, Authors: Jim Ottelé, Andreas S. Hussain, clemens mayer, Sijbren Otto
Version undefined posted 22 October 2019
Posted
Oct 22, 2019
10.26434/chemrxiv.10002032.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Size-Extensive Molecular Machine Learning with Global Descriptors

, Authors: Hyunwook Jung, Sina Stocker, Christian Kunkel, Harald Oberhofer, Byungchan Han, Karsten Reuter, Johannes T. Margraf
Version undefined posted 22 October 2019
Posted
Oct 22, 2019
10.26434/chemrxiv.10002020.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Emergence of Light-Driven Protometabolism upon Recruitment of a Photocatalytic Cofactor by a Self-Replicator

, Authors: Guillermo Monreal Santiago, Kai Liu, Wesley R Browne, Sijbren Otto
Version undefined posted 22 October 2019
Posted
Oct 22, 2019
10.26434/chemrxiv.10002122.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Process Description of an Unconventional Biofilm Formation by Bacterial Cells Autoagglutinating Through Sticky, Long, and Peritrichate Nanofibers

, Authors: Yoshihide Furuichi, Shogo Yoshimoto, Tomohiro Inaba, Nobuhiko Nomura, Katsutoshi Hori
Version undefined posted 22 October 2019
Posted
Oct 22, 2019
10.26434/chemrxiv.10001924.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Direct Observation of Chain Lengths and Conformations in Oligofluorene Distributions from Controlled Polymerization by Double Electron-Electron Resonance

, Authors: Dennis Bücker, Annika Sickinger, Julian D. Ruiz Perez, Manuel Oestringer, Stefan Mecking, Malte Drescher
Version undefined posted 22 October 2019
Posted
Oct 22, 2019
10.26434/chemrxiv.10002785.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Enantioselective alpha-Arylation of Benzamides via Synergistic Nickel and Metallaphotoredox Catalysis

, Authors: John Montgomery, Alexander W. Rand
Version undefined posted 22 October 2019
Posted
Oct 22, 2019
10.26434/chemrxiv.9978824.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Differentiating the Role of Organic Additives to Assemble Open Framework Aluminosilicate Zeolites Using INS Spectroscopy

, Authors: Antony Nearchou, Jeff Armstrong, Keith T. Butler, Paul R. Raithby, Asel Sartbaeva
Version undefined posted 22 October 2019
Posted
Oct 22, 2019
10.26434/chemrxiv.9959876.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Dynamic Structural Changes Accompany the Production of 2-Dihydroxypropanesulfonate by Sulfolactaldehyde Reductase

, Authors: Mahima Sharma, Palika Abayakoon, James P. Lingford, Yi Jin, Ruwan Epa, Ethan D. Goddard-Borger, Gideon J. Davies, Spencer Williams
Version undefined posted 22 October 2019
Posted
Oct 22, 2019
10.26434/chemrxiv.9725120.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Fundamental Design Rules for Turning on Fluorescence in Ionic Molecular Crystals

, Authors: Christopher R. Benson, Laura Kacenauskaite, Katherine L. VanDenburgh, Wei Zhao, Bo Qiao, Tumpa Sadhukhan, Maren Pink, Junsheng Chen, Sina Borgi, Chun-Hsing Chen, Krishnan Raghavachari, Bo W. Laursen, Amar Flood
Version undefined posted 22 October 2019
Posted
Oct 22, 2019
10.26434/chemrxiv.9890141.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Metal Complexes as a Promising Source for New Antibiotics

, Authors: Angelo Frei, Johannes Zuegg, Alysha Elliott, Murray Baker, Stefan Bräse, Christopher Brown, Feng Chen, Christopher Dowson, Gilles Dujardin, Nicole Jung, A. Paden King, Ahmed Mansour, Massimiliano Massi, John Moat, Heba Mohamed, Anna Renfrew, Peter J. Rutledge, Peter J. Sadler, Matthew Todd, Charlotte E. Willans, Justin J. Wilson, Matthew Cooper, Mark A. T. Blaskovich
Version undefined posted 22 October 2019
Posted
Oct 22, 2019
10.26434/chemrxiv.9956744.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Nudged Elastic Band Calculations Accelerated with Gaussian Process Regression Based on Inverse Inter-Atomic Distances

, Authors: Olli-Pekka Koistinen, Vilhjálmur Ásgeirsson, Aki Vehtari, Hannes Jónsson
Version undefined posted 22 October 2019
Posted
Oct 22, 2019
10.26434/chemrxiv.8850440.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Ionophore-Assisted Electrochemistry of Neutral Molecules: Oxidation of Hydrogen in an Ionic Liquid Electrolyte

, Authors: Johannes Wandt, Junqiao Lee, Damien Arrigan, Debbie Silvester
Version undefined posted 22 October 2019
Posted
Oct 22, 2019
10.26434/chemrxiv.7900943.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Enantioselective Olefin Hydrocyanation Without Cyanide

, Authors: Alexander Schuppe, Gustavo M. Borrajo-Calleja, Stephen L. Buchwald
Version undefined posted 23 October 2019
Posted
Oct 23, 2019
10.26434/chemrxiv.10003157.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

A Dual Catalytic Platform for Enabling sp3 α C–H Arylation & Alkylation of Benzamides

, Authors: Hongfei Yin, Liang Xu, Jessica Giacoboni, Raul Martin, ciro Romano, Ruben Martin
Version undefined posted 23 October 2019
Posted
Oct 23, 2019
10.26434/chemrxiv.10003277.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Sampling Conformational Changes of Bound Ligands Using Nonequilibrium Candidate Monte Carlo

, Authors: Sukanya Sasmal, Samuel C. Gill, Nathan M. Lim, David Mobley
Version undefined posted 23 October 2019
Posted
Oct 23, 2019
10.26434/chemrxiv.10003412.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Red Organic Light-Emitting-Diodes based on a N-Annulated Perylene Diimide Dimer

, Authors: Sergey V. Dayneko, Mohammad Rahmati, Majid Pahlevani, Gregory Welch
Version undefined posted 23 October 2019
Posted
Oct 23, 2019
10.26434/chemrxiv.10003418.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

SuFExable Polymers with Helical Structures Derived from Thionyl Tetrafluoride (SOF4)

, Authors: Suhua Li, Gencheng Li, Bing Gao, Sidharam P. Pujari, Xiaoyan Chen, Hyunseok Kim, Feng Zhou, Liana M. Klivansky, Yi Liu, Hafedh Driss, Rachael E. Impey, Tatiana P. Soares da Costa, Jianmei Lu, Peng Wu, Han Zuilhof, John E. Moses, K. Barry Sharpless
Version undefined posted 23 October 2019
Posted
Oct 23, 2019
10.26434/chemrxiv.10005758.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Formation of Enamines via Catalytic Dehydrogenation by Pincer-Iridium Complexes

, Authors: Xiawei Zhang, Santanu Malakar, Karsten Krogh-Jespersen, Faraj Hasanayn, Alan Goldman
Version undefined posted 23 October 2019
Posted
Oct 23, 2019
10.26434/chemrxiv.10006607.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

The Role of Sodium Sulfate Supporting Electrolyte in Ammonium Transport and Reduction at Interface Between Platinum Cathode and Solution

, Authors: Linji Xu, Yunsong Pang, Dezhao Huang, Huichuan Zhuang, Wenzong Liu, Tengfei Luo, Po-Heng Lee, Li Feng, Junchi Lu
Version undefined posted 23 October 2019
Posted
Oct 23, 2019
10.26434/chemrxiv.10006712.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Exploring the Dynamics of Bound Water in Nylon Polymers with Terahertz Spectroscopy

, Authors: Hiromichi Hoshina, Takuro Kanemura, Chiko Otani, Michael Ruggiero
Version undefined posted 23 October 2019
Posted
Oct 23, 2019
10.26434/chemrxiv.10007027.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

A Possible Mechanism behind the Discovery of Prussian Blue

, Authors: Youxin Duan, Junyan Zhang
Version undefined posted 23 October 2019
Posted
Oct 23, 2019
10.26434/chemrxiv.10007033.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Direct C–H Alpha Arylation of Enones with ArI(O2CR)2 Reagents

, Authors: Felipe Cesar Sousa e Silva, Nguyen T Van, Sarah Wengryniuk
Version undefined posted 23 October 2019
Posted
Oct 23, 2019
10.26434/chemrxiv.10007213.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Chiral Tetrahydropyridines via FeCl3-Catalyzed Carbonyl-Olefin Metathesis

, Authors: Katie Rykaczewski, Emilia J. Groso, Hannah L. Vonesh, Mario Gaviria, Alistair D. Richardson, Troy E. Zehnder, Corinna Schindler
Version undefined posted 23 October 2019
Posted
Oct 23, 2019
10.26434/chemrxiv.10007291.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Organobase-Catalyzed Hydroxyl-yne Click Polymerization

, Authors: Han Si, Kaojin Wang, Bo Song, Anjun Qin, Ben Zhong Tang
Version undefined posted 23 October 2019
Posted
Oct 23, 2019
10.26434/chemrxiv.10007510.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Understanding Chemical Selectivity Through Well Selected Excited States

, Authors: Frédéric Guégan, Thomas Pigeon, Frank de Proft, Vincent Tognetti, Laurent Joubert, Henry Chermette, Paul W. Ayers, Dominique Luneau, Christophe Morell
Version undefined posted 23 October 2019
Posted
Oct 23, 2019
10.26434/chemrxiv.10007627.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Plasmonic Oligomers With Tunable Conductive Nanojunctions

, Authors: Xiaoyan Li, Jieli Lyu, Claire Goldmann, Mathieu Kociak, Doru Constantin, Cyrille Hamon
Version undefined posted 23 October 2019
Posted
Oct 23, 2019
10.26434/chemrxiv.10007783.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Chemically Induced Splay Nematic Phase with Micron Scale Periodicity

, Authors: Perri Connor, Richard Mandle
Version undefined posted 23 October 2019
Posted
Oct 23, 2019
10.26434/chemrxiv.10009007.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Reaction Cycling for Efficient Kinetic Analysis in Flow

, Authors: Ryan Sullivan, Stephen Newman
Version undefined posted 23 October 2019
Posted
Oct 23, 2019
10.26434/chemrxiv.10009013.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Efficient Escherichia coli (E. coli) Trapping and Retrieval from Bodily Fluids via a Three-Dimensional (3D) Microbeads Stacked Nano-Device

, Authors: Xinye Chen, Abbi miller, Shengting Cao, Yu Gan, Jie Zhang, Qian He, Ruo-Qian Wang, Xin Yong, Peiwu Qin, Blanca Lapizco-Encinas, Ke Du
Version undefined posted 23 October 2019
Posted
Oct 23, 2019
10.26434/chemrxiv.10009967.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

The Limited Influence of Transference Number on the Performance of Nanoscale Batteries

, Authors: Kaitlyn Dwelle, Adam Willard
Version undefined posted 23 October 2019
Posted
Oct 23, 2019
10.26434/chemrxiv.9981407.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Catalytic Asymmetric Radical-Polar Crossover Hydroalkoxylation

, Authors: Christopher Discolo, Eric Touney, Sergey Pronin
Version undefined posted 23 October 2019
Posted
Oct 23, 2019
10.26434/chemrxiv.9808355.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Native Defects and their Doping Response in the Lithium Solid Electrolyte Li7La3Zr2O12

, Authors: Alex Squires, David Scanlon, Benjamin Morgan
Version undefined posted 23 October 2019
Posted
Oct 23, 2019
10.26434/chemrxiv.9031346.v3
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Optimizing the Atomic Layer Deposition of Alumina on Perovskite Nanocrystal Films by Using O2 as a Molecular Probe

, Authors: Seryio Saris, Sanduni Dona, Valerie Niemann, Anna Loiudice, Raffaella Buonsanti
Version undefined posted 23 October 2019
Posted
Oct 23, 2019
10.26434/chemrxiv.9991919.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Synthesis of Germanosilicate Zeolite HPM-12 Using a Short Imidazolium-based Dication: Structure-Direction by Charge-to-Charge Distance Matching

, Authors: Peng Lu, Luis Gómez-Hortigüela, Zihao Gao, Miguel Camblor
Version undefined posted 23 October 2019
Posted
Oct 23, 2019
10.26434/chemrxiv.10003151.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Redox Polymers Incorporating Pendant 6-Oxoverdazyl and Nitronyl Nitroxide Radicals

, Authors: Michael Anghel, Francois Magnan, Sara D. Catingan, Matthew A. McCready, Elaheh Aawani, Victor Wong, Deepa Singh, Giovanni Fanchini, Joe Gilroy
Version undefined posted 23 October 2019
Posted
Oct 23, 2019
10.26434/chemrxiv.9902576.v2
by ChemRxiv
 
Subject: Politics and International Relations
,
Working Paper
, Title:

Interrogating the Appropriation of Spaces of Caste in Pakistan: Ambedkarian Perspective on Progressive Religio-Political Projections in Sindhi Short Stories and in Everyday Politics

, Authors: Ghulam Hussain
Version undefined posted 24 October 2019
Posted
Oct 24, 2019
10.33774/apsa-2019-wlx66-v2
by APSA Preprints
 
Subject: Chemistry
,
Working Paper
, Title:

On the Design of Molecular Excitonic Circuits for Quantum Computing: The Universal Quantum Gates

, Authors: Maria Castellanos, Amro Dodin, Adam Willard
Version undefined posted 24 October 2019
Posted
Oct 24, 2019
10.26434/chemrxiv.9991976.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Synthesis of 1,2-Dihydroisoquinolines by a Modified Pomeranz-Fritsch Cyclization

, Authors: Xiang Ji, Zheng Huang, Jean-Philip Lumb
Version undefined posted 24 October 2019
Posted
Oct 24, 2019
10.26434/chemrxiv.9999971.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Nitroreductase-Mediated Release of Inhibitors of Lysine-Specific Demethylase 1 (LSD1) from Prodrugs in Transfected Acute Myeloid Leukaemia Cells

, Authors: Manfred Jung, Eva-Maria Herrlinger, Mirjam Hau, Desiree M. Redhaber, Gabriele Greve, Dominica Willmann, Simon Steimle, Michael Müller, Michael Lübbert, Cornelius Miething, Roland Schüle
Version undefined posted 24 October 2019
Posted
Oct 24, 2019
10.26434/chemrxiv.10012937.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Robot-Accelerated Perovskite Investigation and Discovery (RAPID): 1. Inverse Temperature Crystallization

, Authors: Zhi Li, Mansoor Ani Najeeb, Liana Alves, Alyssa Sherman, Peter Cruz Parrilla, Ian M. Pendleton, Matthias Zeller, Joshua Schrier, Alexander J. Norquist, Emory Chan
Version undefined posted 24 October 2019
Posted
Oct 24, 2019
10.26434/chemrxiv.10013090.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Electrostatics, Hydrogen Bonding, and Molecular Structure at Polycation and Peptide:Lipid Membrane Interfaces

, Authors: Naomi Dalchand, Qiang Cui, Franz Geiger
Version undefined posted 24 October 2019
Posted
Oct 24, 2019
10.26434/chemrxiv.10014797.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Stereocontrolled Synthesis of Melokhanine E via an Intramolecular Formal [3+2] Cycloaddition

, Authors: Joshua Pierce, Anna Cholewczynski, Peyton Williams
Version undefined posted 24 October 2019
Posted
Oct 24, 2019
10.26434/chemrxiv.10022858.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Voltage Imaging with a NIR-Absorbing Phosphine Oxide Rhodamine Voltage Reporter

, Authors: Monica Gonzalez, Alison Walker, Kevin Cao, Julia Lazzari-Dean, Nick Settineri, Eui Ju Kong, Richard Kramer, Evan Miller
Version undefined posted 24 October 2019
Posted
Oct 24, 2019
10.26434/chemrxiv.10025789.v1
by ChemRxiv
 
Subject: Politics and International Relations
,
Working Paper
, Title:

A Practitioner's Perspective on Institutionalizing Voter Registration on College & University Campuses

, Authors: Robert Donahue
Version undefined posted 25 October 2019
Posted
Oct 25, 2019
10.33774/apsa-2019-4pw4f
by APSA Preprints
 
Subject: Chemistry
,
Working Paper
, Title:

In Silico Druggability Assessment of the NUDIX Hydrolase Protein Family as a Workflow for Target Prioritization

, Authors: Maurice Michel, Evert J. Homan, Elisee Wiita, Kia Pedersen, Ingrid Almlöf, Anna-Lena Gustavsson, Thomas Lundbäck, Thomas Helleday, Ulrika Warpman Berglund
Version undefined posted 25 October 2019
Posted
Oct 25, 2019
10.26434/chemrxiv.10026929.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Sequential Immobilization of Ansa-Hafnocene Complexes for Propene Polymerization

, Authors: Marius Arz, Tim Kratky, Sebastian Günther, Katia Rodewald, Thomas Burger, Manfred Heuberger, Bernhard Rieger
Version undefined posted 25 October 2019
Posted
Oct 25, 2019
10.26434/chemrxiv.10028348.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Re-Evaluating the Mechanism of Action of α,β-Unsaturated Carbonyl DUB Inhibitors B-AP15 and VLX1570: A Paradigmatic Example of Unspecific Protein Crosslinking with Michael Acceptor Motif-Containing Drugs

, Authors: Jennifer Ward, Adán Pinto-Fernández, LoÏc Cornelissen, Sarah Bonham, Laura Diaz Saez, Olivier Riant, Kilian Huber, Benedikt M. Kessler, Olivier Feron, Edward W. Tate
Version undefined posted 25 October 2019
Posted
Oct 25, 2019
10.26434/chemrxiv.10028444.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

A General Carbonyl Alkylative Amination Process for Tertiary Amine Synthesis

, Authors: Roopender Kumar, Nils Floden, William G. Whitehurst, Matthew Gaunt
Version undefined posted 25 October 2019
Posted
Oct 25, 2019
10.26434/chemrxiv.10028504.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Chemical Bonding Analysis in Ti1-x-yAlxTayN Solid Solutions

, Authors: Sergey Eremeev, A. R. Shugurov
Version undefined posted 25 October 2019
Posted
Oct 25, 2019
10.26434/chemrxiv.10028600.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Anionic and Cationic Redox Processes in β-Li2IrO3 and Their Structural Implications on Electrochemical Cycling in Li-Ion Cell

, Authors: Paul Pearce, Gaurav Assat, Antonella Iadecola, François Fauth, Rémi Dedryvère, Artem Abakumov, Gwenaëlle Rousse, Jean-Marie Tarascon
Version undefined posted 25 October 2019
Posted
Oct 25, 2019
10.26434/chemrxiv.10028603.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Using Bayesian Model Selection to Advise Neutron Reflectometry Analysis from Langmuir-Blodgett Monolayers

, Authors: Andrew McCluskey, Tom Arnold, Joshaniel F. K. Cooper, Tim Snow
Version undefined posted 25 October 2019
Posted
Oct 25, 2019
10.26434/chemrxiv.10028978.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Lysine Acylation Using Conjugating Enzymes (LACE) for Site-Specific Modification and Ubiquitination of Native Proteins

, Authors: Raphael Hofmann, Gaku Akimoto, Thomas G. Wucherpfennig, Cathleen Zeymer, Jeffrey Bode
Version undefined posted 25 October 2019
Posted
Oct 25, 2019
10.26434/chemrxiv.10028900.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Adhesion and Surface Layers on Silicon Anodes Suppress Formation of c-Li3.75Si and Solid Electrolyte Interphase

, Authors: Hezhen Xie, Sayed Youssef Sayed, W. Peter Kalisvaart, Simon Jakob Schaper, Peter Müller-Buschbaum, Erik Luber, Brian Olsen, Martin Haese, Jillian Buriak
Version undefined posted 25 October 2019
Posted
Oct 25, 2019
10.26434/chemrxiv.10029068.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Real-Time Video Imaging of Mechanical Motions of a Single Molecular Shuttle

, Authors: Toshiki Shimizu, Dominik Lungerich, Joshua Stuckner, Mitsuhiro Murayama, Koji Harano, Eiichi Nakamura
Version undefined posted 25 October 2019
Posted
Oct 25, 2019
10.26434/chemrxiv.10029194.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

A Molecular-Level Mechanism of the Biological N2 Fixation

, Authors: Vanessa Jane Bukas, Jens Kehlet Nørskov
Version undefined posted 25 October 2019
Posted
Oct 25, 2019
10.26434/chemrxiv.10029224.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Visualizing 3D Molecular Structures Using an Augmented Reality App

, Authors: Kristina Eriksen, Bjarne Nielsen, Michael Pittelkow
Version undefined posted 25 October 2019
Posted
Oct 25, 2019
10.26434/chemrxiv.10031888.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

A Maltol-Containing Ruthenium Polypyridyl Complex as a Potential Anticancer Agent

, Authors: Anna Notaro, Marta Jakubaszek, Severin Koch, Riccardo Rubbiani, Orsolya Dömötör, Eva Enyedy, Mazzarine Dotou, Fethi Bedioui, Mickaël Tharaud, Bruno Goud, Stefano Ferrari, Enzo Alessio, Gilles Gasser
Version undefined posted 25 October 2019
Posted
Oct 25, 2019
10.26434/chemrxiv.10008917.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Third-Generation Method for High Throughput Quantification of Trace Palladium by Color or Fluorescence

, Authors: Lydia Lukomski, Ivanna Pohorilets, Kazunori Koide
Version undefined posted 25 October 2019
Posted
Oct 25, 2019
10.26434/chemrxiv.10032128.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Heterolytic Hydrogen Activation: Understanding Support Effects in Water-Gas Shift, Hydrodeoxygenation, and CO Oxidation Catalysis

, Authors: Nicholas Nelson, János Szanyi
Version undefined posted 25 October 2019
Posted
Oct 25, 2019
10.26434/chemrxiv.10032131.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Identifying the Molecular Edge Termination of Exfoliated Hexagonal Boron Nitride Nanosheets with Solid-State NMR Spectroscopy and Plane-Wave DFT Calculations

, Authors: Rick W. Dorn, Matthew J. Ryan, Tae-Hoon Kim, Tian Wei Goh, Patrick M. Heintz, Lin Zhou, Wenyu Huang, Aaron Rossini
Version undefined posted 25 October 2019
Posted
Oct 25, 2019
10.26434/chemrxiv.10032170.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Control of Stereoselectivity in Diverse Hapalindole Metabolites Is Mediated by Cofactor Induced Combinatorial Pairing of Stig Cyclases

, Authors: Shasha Li, Sean A. Newmister, andrew n. lowell, Jiachen Zi, Callie R. Chappell, Fengan Yu, Robert M. Hohlman, Jimmy Orjala, Robert M. Williams, David H. Sherman
Version undefined posted 25 October 2019
Posted
Oct 25, 2019
10.26434/chemrxiv.10032260.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Electrochemical CO2 Reduction on Nanostructured Metal Electrodes: Fact or Defect?

, Authors: Recep Kas, Kailun Yang, Divya Bohra, Ruud Kortlever, Thomas Burdyny, Wilson A. Smith
Version undefined posted 25 October 2019
Posted
Oct 25, 2019
10.26434/chemrxiv.10032278.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

GPU-Accelerated Implementation of Continuous Constant pH Molecular Dynamics in Amber: pKa Predictions with Single-pH Simulations

, Authors: Robert C. Harris, Jana Shen, Yandong Huang
Version undefined posted 25 October 2019
Posted
Oct 25, 2019
10.26434/chemrxiv.9642071.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Large Scale Indium Tin Oxide (ITO) One Dimensional Gratings for Ultrafast Signal Modulation in the Visible

, Authors: Michele Guizzardi, Silvio Bonfadini, Liliana Moscardi, Ilka Kriegel, Francesco Scotognella, Luigino Criante
Version undefined posted 25 October 2019
Posted
Oct 25, 2019
10.26434/chemrxiv.10026932.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Liquid Crystal Trimers Incorporating Saturated Isosteres of Benzene and Exhibiting Modulated Nematic Phases

, Authors: Adam Al-Janabi, Richard Mandle
Version undefined posted 28 October 2019
Posted
Oct 28, 2019
10.26434/chemrxiv.10033184.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Simultaneous Monitoring of Crystalline Active Materials and Resistance Evolution in Lithium-Sulfur Batteries

, Authors: Yu-Chuan Chien, Ashok Menon, William Brant, Daniel Brandell, Matthew Lacey
Version undefined posted 28 October 2019
Posted
Oct 28, 2019
10.26434/chemrxiv.10038458.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Synthesis of 3-Azidopropyl-Functionalized GalNAc-β-(1→4)-Gal Natural Disaccharide

, Authors: Sebastien Vidal, Dominique Lafont, Shuai Wang
Version undefined posted 28 October 2019
Posted
Oct 28, 2019
10.26434/chemrxiv.10042907.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Small Molecule NF-kB Inhibitors as Immune Potentiators for Enhancement of Vaccine Adjuvants

, Authors: Brittany Moser, Yoseline Escalante-Buendia, Rachel C. Steinhardt, Matthew Rosenberger, Britteny Cassaidy, Nihesh Naorem, Alfred C. Chon, Minh nguyen, Ngoctran Tran, Aaron Esser-Kahn
Version undefined posted 28 October 2019
Posted
Oct 28, 2019
10.26434/chemrxiv.10043138.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Natural Flavonoids as Superior Reagents for Separation of Clinically Important Zr Radionuclides

, Authors: Kalpita Ghosh, Nabanita Naskar, Dibyasree Choudhury, Susanta Lahiri
Version undefined posted 28 October 2019
Posted
Oct 28, 2019
10.26434/chemrxiv.10043237.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Designing Iron Oxide Nanoparticles for Image Guided Thermal Medicine Applications

, Authors: Hattie Ring, Sheng Tong, Zhe Gao, Navid Manuchehrabadi, Kaiyi Jiang, Sylvie Pailloux, Mark Dresel, Valérie Pierre, Christy Haynes, Michael Garwood, Gang Bao, John Bischof
Version undefined posted 28 October 2019
Posted
Oct 28, 2019
10.26434/chemrxiv.10045850.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Self-Limiting Electrospray Deposition for the Surface Modification of Additively Manufactured Parts

, Authors: Dylan A. Kovacevich, Lin Lei, Daehoon Han, Christianna Kutznetsova, Howon Lee, Jonathan Singer
Version undefined posted 28 October 2019
Posted
Oct 28, 2019
10.26434/chemrxiv.10045931.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Iridium-Catalyzed Silylation of Five-Membered Heteroarenes: High Sterically Derived Selectivity from a Pyridyl-Imidazoline Ligand

, Authors: Caleb Karmel, Camille Rubel, Elena Kharitonova, John Hartwig
Version undefined posted 28 October 2019
Posted
Oct 28, 2019
10.26434/chemrxiv.10046525.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Ionic Fluorogels for Remediation of Per- and Polyfluorinated Alkyl Substances from Water.

, Authors: Elango Kumarasamy, Irene Manning, Leonard B. Collins, Orlando Coronell, Frank Leibfarth
Version undefined posted 28 October 2019
Posted
Oct 28, 2019
10.26434/chemrxiv.10046576.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Decarbonylative Olefination of Aldehydes to Alkenes

, Authors: Diana Ainembabazi, Christopher Reid, Amanda Chen, Jakub Kostal, Adelina Voutchkova-Kostal
Version undefined posted 28 October 2019
Posted
Oct 28, 2019
10.26434/chemrxiv.10046615.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

C–H Functionalization Approach for the Synthesis of Chiral C2 Symmetric 1,5-Cyclooctadienes Ligands

, Authors: Bowen Zhang, Michael Hollerbach, Simon Blakey, Huw Davies
Version undefined posted 28 October 2019
Posted
Oct 28, 2019
10.26434/chemrxiv.10032209.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Active and Unidirectional Acceleration of Biaryl Rotation by a Molecular Motor

, Authors: Edgar Uhl, Peter Mayer, Henry Dube
Version undefined posted 29 October 2019
Posted
Oct 29, 2019
10.26434/chemrxiv.10048871.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

In-Plate Metabolomics of Single Zebrafish Embryos

, Authors: Anton Ribbenstedt, Malte Posselt, Carl Brunius, Jonathan P. Benskin
Version undefined posted 29 October 2019
Posted
Oct 29, 2019
10.26434/chemrxiv.10048550.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

A Bis-Monophospholyl Dysprosium Cation Showing Magnetic Hysteresis at 48 Kelvin

, Authors: Peter Evans, Daniel Reta, George F. S. Whitehead, Nicholas Chilton, David Mills
Version undefined posted 29 October 2019
Posted
Oct 29, 2019
10.26434/chemrxiv.10050128.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Can Doping of Transition Metal Oxide Cathode Materials Increase Achievable Voltages with Multivalent Metals?

, Authors: Daniel Koch, Sergei Manzhos
Version undefined posted 29 October 2019
Posted
Oct 29, 2019
10.26434/chemrxiv.10050575.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

The Evolution Pathway from Iron Compounds to Fe1(II)-N4 Sites Through Gas-Phase Iron During Pyrolysis

, Authors: Jingkun Li, Li Jiao, Evan Wegener, Lynne K. LaRochelle Richard, Ershuai Liu, andrea Zitolo, Moulay-Tahar Sougrati, Sanjeev Mukerjee, Zipeng Zhao, Yu Huang, Fan Yang, Sichen Zhong, Hui Xu, A. Jeremy Kropf, Frederic Jaouen, Deborah J. Myers, Qingying Jia
Version undefined posted 29 October 2019
Posted
Oct 29, 2019
10.26434/chemrxiv.10050515.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Improved Deep-Red Phosphorescence in Cyclometalated Iridium Complexes via Ancillary Ligand Modification

, Authors: Evanta Kabir, Steven Sittel, Boi-Lien Nguyen, Thomas Teets
Version undefined posted 29 October 2019
Posted
Oct 29, 2019
10.26434/chemrxiv.10052348.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Heterologous Production of Lasso Peptide Capistruin in a Burkholderia Host

, Authors: Sylvia Kunakom, Alessandra Eustaquio
Version undefined posted 29 October 2019
Posted
Oct 29, 2019
10.26434/chemrxiv.10052363.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Machine Learning Assisted Synthesis of Metal-Organic Nanocapsules

, Authors: Yunchao xie, Chen Zhang, Xiangquan Hu, Chi Zhang, Steven P. Kelley, Jerry L. Atwood, Jian Lin
Version undefined posted 29 October 2019
Posted
Oct 29, 2019
10.26434/chemrxiv.10052450.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Total Synthesis and Structural Verification of Isatindigotindoline C

, Authors: Juha Siitonen, Muhammed Yousufuddin, Laszlo Kurti
Version undefined posted 29 October 2019
Posted
Oct 29, 2019
10.26434/chemrxiv.10052531.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Thinking Globally, Acting Locally: On the Issue of Training Set Imbalance and the Case for Local Machine Learning Models in Chemistry

, Authors: Mojtaba Haghighatlari, Ching-Yen Shih, Johannes Hachmann
Version undefined posted 29 October 2019
Posted
Oct 29, 2019
10.26434/chemrxiv.8796947.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Chemoenzymatic ortho-quinone methide formation

, Authors: Tyler Doyon, Jonathan Perkins, Summer A. Baker Dockrey, Evan O. Romero, Kevin Skinner, Paul M. Zimmerman, Alison Narayan
Version undefined posted 29 October 2019
Posted
Oct 29, 2019
10.26434/chemrxiv.7828769.v3
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Rh(III)-Catalyzed Direct Access to 2,3-Substituted β-N-Glycosyl Indoles Through C-H Activation/annulation Coupling of β-N-Aryl Glycosides with Substituted Internal Alkynes

, Authors: Samir Messaoudi, Olivier Provot, Mouad Alami, Guangkuan Zhao, Mingxiang Zhu
Version undefined posted 29 October 2019
Posted
Oct 29, 2019
10.26434/chemrxiv.10031882.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

The ‘Inverted Bond’ revisited. Analysis of ‘in silico’ models and of [1.1.1]Propellane using Orbital Forces

, Authors: Rubén Laplaza, Julia Contreras-García, Franck Fuster, François Volatron, Patrick Chaquin
Version undefined posted 29 October 2019
Posted
Oct 29, 2019
10.26434/chemrxiv.7215269.v4
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

A Practical Iron-Based Newman-Kwart Rearrangement Under Oxidative Conditions

, Authors: Thibault Gendron, Raul Pereira, Hafsa Yusuf Abdi, Timothy Witney, Erik Arstad
Version undefined posted 29 October 2019
Posted
Oct 29, 2019
10.26434/chemrxiv.10028597.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Facile Electron Transfer to CO2 during Adsorption at the Metal | Solution Interface

, Authors: Joseph Gauthier, Meredith Fields, Michal Bajdich, Leanne D. Chen, Robert B. Sandberg, Karen Chan, Jens Kehlet Nørskov
Version undefined posted 29 October 2019
Posted
Oct 29, 2019
10.26434/chemrxiv.8187629.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Chiral-Induced Spin Selectivity: A Symmetry Analysis of Electronic Transmission

, Authors: Martin Sebastian Zöllner, Solmar Varela, Ernesto Medina, Vladimiro Mujica, Carmen Herrmann
Version undefined posted 29 October 2019
Posted
Oct 29, 2019
10.26434/chemrxiv.8325248.v2
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Optimizing Electrostatic Similarity for Virtual Screening: A New Methodology

, Authors: Savíns Puertas Martín, Juana Lopez Redondo, Horacio Pérez-Sánchez, Pilar Martínez Ortigosa
Version undefined posted 30 October 2019
Posted
Oct 30, 2019
10.26434/chemrxiv.10044272.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Dynamic Effects May Affect Hammett Linear Free Energy Relationship

, Authors: Xinyu Xu, Zongchang Han
Version undefined posted 30 October 2019
Posted
Oct 30, 2019
10.26434/chemrxiv.10055411.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Kinobead/LC-MS Phosphokinome Profiling Enables Rapid Analyses of Kinase-Dependent Cell Signaling Networks

, Authors: Martin Golkowski, Venkata Narayana Vidadala, Ho-Tak Lau, Anna Shoemaker, Masami Shimizu-Albergine, Joseph A. Beavo, Dustin J. Maly, Shao-En Ong
Version undefined posted 30 October 2019
Posted
Oct 30, 2019
10.26434/chemrxiv.10055429.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Simulation of Light Propagation in Photochemical Fixed-Bed Reactors Using a BRDF-Based Model

, Authors: Bruno Ramos, Franco Grisafi, Alberto Brucato, Antonio Carlos Silva Costa Teixeira
Version undefined posted 30 October 2019
Posted
Oct 30, 2019
10.26434/chemrxiv.10055555.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Ligand Redox Non-Innocence in [Coᴵᴵᴵ(TAML)]0/‒ Complexes Affects Nitrene Formation

, Authors: Nicolaas P. van Leest, Martijn A. Tepaske, Jean-Pierre H. Oudsen, Bas Venderbosch, Niels R. Rietdijk, Maxime A. Siegler, Moniek Tromp, Jarl Ivar van der Vlugt, Bas de Bruin
Version undefined posted 30 October 2019
Posted
Oct 30, 2019
10.26434/chemrxiv.10059809.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Accuracy of Spin-Component Scaled ADC(2) Excitation Energies and Potential Energy Surfaces

, Authors: Attila Tajti, Levente Tulipan, Péter Szalay
Version undefined posted 30 October 2019
Posted
Oct 30, 2019
10.26434/chemrxiv.10059974.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Reimagining Third Phase Formation as the Miscibility Gap of a Molecular Solution

, Authors: Michael Servis, David T. Wu, Jenife Shafer, Aurora Clark
Version undefined posted 30 October 2019
Posted
Oct 30, 2019
10.26434/chemrxiv.10060253.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

The Role of Surfactant Force Field on the Properties of Liquid/Liquid Interfaces

, Authors: Michael Servis, Alex McCue, Amanda Casella, Aurora Clark
Version undefined posted 30 October 2019
Posted
Oct 30, 2019
10.26434/chemrxiv.10060262.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Clickable Galactose Analogs for Imaging Glycans in Developing Zebrafish

, Authors: Jessica Daughtry, Wendy Cao, Johnny Ye, Jeremy Baskin
Version undefined posted 31 October 2019
Posted
Oct 31, 2019
10.26434/chemrxiv.10083383.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Discovery of a Potent and Selective Covalent Inhibitor and Activity-Based Probe for the Deubiquitylating Enzyme UCHL1, with Anti-Fibrotic Activity

, Authors: Nattawadee Panyain, Aurélien Godinat, Thomas Lanyon-Hogg, Sofía Lachiondo-Ortega, Edward J. Will, Christelle Soudy, Katie Mason, Sarah Elkhalifa, Lisa M. Smith, Jeanine A. Harrigan, Edward Tate
Version undefined posted 31 October 2019
Posted
Oct 31, 2019
10.26434/chemrxiv.10058429.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

In Vitro Blood-Brain-Barrier Permeability and Cytotoxicity of Atorvastatin-Loaded Nanoformulation Against Glioblastoma in 2D and 3D Models

, Authors: Michael M Lübtow, Sabrina Oertner, Sabina Quader, Elisabeth Jeanclos, Alevtina Cubukova, Marion Krafft, Clemens Schulte, Laura Meier, Maximilian Rist, Oltea Sampetrean, Hiroaki Kinoh, Antje Gohla, Kazunori Kataoka, Antje Appelt-Menzel, Robert Luxenhofer
Version undefined posted 31 October 2019
Posted
Oct 31, 2019
10.26434/chemrxiv.10067993.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

A Chemistry Based Service-Learning Course in New Orleans: Increasing Student Interest and Self-Efficacy in STEM

, Authors: Ryan Vik, Emily Schmidt, Cooper Battle, Janarthanan Jayawickramarajah
Version undefined posted 31 October 2019
Posted
Oct 31, 2019
10.26434/chemrxiv.10062014.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Discovery and Optimization of Novel Pyridines as Highly Potent and Selective Glycogen Synthase Kinase 3 Inhibitors

, Authors: Savithri Ramurthy, Keith B. Pfister, Rustum S. Boyce, Sean P. Brown, Abran Q. Costales, Manoj Desai, Eric Fang, Barry H. Levine, Simon C. Ng, John M. Nuss, David B. Ring, Cynthia M. Shafer, Wei Shu, Sharada Subramanian, Allan S. Wagman, Haixia Wang, Dirksen Bussiere
Version undefined posted 31 October 2019
Posted
Oct 31, 2019
10.26434/chemrxiv.10070258.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

A Site-Selective Amination Catalyst Discriminates Between Nearly Identical C-H Bonds of Unsymmetrical Disubstituted Alkenes

, Authors: Tomislav Rovis, Honghui Lei
Version undefined posted 31 October 2019
Posted
Oct 31, 2019
10.26434/chemrxiv.10072460.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

High-Performance Iron-Based ORR Catalysts Synthesized via Chemical Vapor Deposition

, Authors: Li Jiao, Jingkun Li, Lynne K. LaRochelle Richard, Thomas Stracensky, Ershuai Liu, Qiang Sun, Moulay-Tahar Sougrati, Zipeng Zhao, Fan Yang, Sichen Zhong, Hui Xu, Sanjeev Mukerjee, Yu Huang, Deborah J. Myers, Frédéric Jaouen, Qingying Jia
Version undefined posted 31 October 2019
Posted
Oct 31, 2019
10.26434/chemrxiv.10072475.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Iodane-Guided C-H Cleavage to Synthesize Densely Functionalized Arenes

, Authors: Aleksandra Nilova, Paul A. Sibbald, Edward. J. Valente, Gisela Gonzalez-Monteil, H. Camille Richardson, Kevin S. Brown, Paul Cheong, David Stuart
Version undefined posted 31 October 2019
Posted
Oct 31, 2019
10.26434/chemrxiv.10072973.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Force Field Partial Charges with Restrained Electrostatic Potential 2 (RESP2)

, Authors: Michael Schauperl, Paul Nerenberg, Hyesu Jang, Lee-Ping Wang, Christopher I. Bayly, David Mobley, Michael Gilson
Version undefined posted 31 October 2019
Posted
Oct 31, 2019
10.26434/chemrxiv.10072799.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Thermal Decomposition of the HXeCl···H2O Complex in Solid Xenon: Experimental Characterization of the Two-body Decomposition Channel

, Authors: Masashi Tsuge, Markku Räsänen, Leonid Khriachtchev
Version undefined posted 31 October 2019
Posted
Oct 31, 2019
10.26434/chemrxiv.10075409.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Unusual Structures, Phase Behavior, and Fluorescent Properties of 3-phenyl-1-(pyridin-2-yl)-1H-pyrazol-5-amine and Its’ ZnCl2 Complex

, Authors: Lana K. Hiscock, Delara Joekar, Zachary W. Schroeder, Victoria Jarvis, Kenneth E. Maly, Louise Dawe
Version undefined posted 31 October 2019
Posted
Oct 31, 2019
10.26434/chemrxiv.10078943.v1
by ChemRxiv
 
Subject: Chemistry
,
Working Paper
, Title:

Sterol Uptake by an Alkali-Beta-Cyclodextrin Metal-Organic Framework

, Authors: Barry Blight, Towseef I Ahmad, Helena J. Shepherd, Christopher S. Jennings, Livia I Ferland, Simon J Teat, Jeremy S. Rossman
Version undefined posted 31 October 2019
Posted
Oct 31, 2019
10.26434/chemrxiv.10073072.v1
by ChemRxiv
 
Subject: Politics and International Relations
,
Working Paper
, Title:

What We Know about How to Mobilize College Students to Vote

, Authors: Elizabeth Bennion, David Nickerson
Version undefined posted 31 October 2019
Posted
Oct 31, 2019
10.33774/apsa-2019-t0f6g
by APSA Preprints
 
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