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Chemistry

Working Paper

psm_utils: A high level Python API for parsing and handling peptide-spectrum-matches and proteomics search results

Ralf Gabriels, Arthur Declercq, Robbin Bouwmeester, Sven Degroeve, Lennart Martens

Version 1 posted 03 October 2022

449

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1

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Chemistry

Working Paper

Noise Reduction of Low Count STEM-EDX Data by Low-rank Regularized Spectral Smoothing

Keisuke Ozawa

Version 2 posted 15 September 2022

462

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Chemistry

Working Paper

Custom ML Module of AIDrugApp for Molecular Identification, Descriptor Calculation, and Building ML/DL QSAR Models

Divya Karade

Version 1 posted 08 November 2021

458

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1

Citations

Chemistry

Working Paper

Interlaboratory Study Assessing the Analysis of Supercapacitor Electrochemistry Data

Jamie W. Gittins, Yuan Chen, Stefanie Arnold, Veronica Augustyn, Andrea Balducci, Thierry Brousse, Elzbieta Frackowiak, Pedro Gómez-Romero, Archana Kanwade, Lukas Köps, Plawan Kumar Jha, Dongxun Lyu, Michele Meo, Deepak Pandey, Le Pang, Volker Presser, Mario Rapisarda, Daniel Rueda-García, Saeed Saeed, Parasharam M. Shirage, Adam Ślesiński, Francesca Soavi, Jayan Thomas, Maria-Magdalena Titirici, Hongxia Wang, Zhen Xu, Aiping Yu, Maiwen Zhang, Alexander C. Forse

Version 2 posted 01 August 2023

1,062

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Chemistry

Working Paper

hplc-py: A Python Package For Rapid Peak Quantification in Complex Chromatograms

Griffin Chure, Jonas Cremer

Version 1 posted 09 October 2023

1,031

Downloads

Chemistry

Working Paper

Soft Potato: an open source electrochemical simulator and toolkit

Oliver Rodríguez

Version 1 posted 02 November 2022

743

Downloads

2

Citations

Chemistry

Working Paper

Cutting Through the Noise: Extracting Dynamics from Ultrafast Spectra using Dynamic Mode Decomposition

Cong Xu, Carlos Baiz

Version 1 posted 07 September 2023

345

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Chemistry

Review

Machine learning-based peptide-spectrum match rescoring opens up the immunopeptidome

Charlotte Adams, Kris Laukens, Wout Bittremieux, Kurt Boonen

Version 1 posted 06 September 2023

429

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Chemistry

Working Paper

pyBinder: Label-free Quantitation to Advance Affinity Selection-Mass Spectrometry

Joseph S. Brown, Michael A. Lee, Wayne Vuong, Andrei Loas, Bradley L. Pentelute

Version 1 posted 20 August 2024

562

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Chemistry

Working Paper

iSIM: Instant Similarity

Kenneth Lopez Perez, Taewon Kim, Ramon Miranda-Quintana

Version 1 posted 17 November 2023

1,362

Downloads

1

Citations

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40 results in Data Analysis in Keywords: Data Analysis

psm_utils: A high level Python API for parsing and handling peptide-spectrum-matches and proteomics search results

Noise Reduction of Low Count STEM-EDX Data by Low-rank Regularized Spectral Smoothing

Custom ML Module of AIDrugApp for Molecular Identification, Descriptor Calculation, and Building ML/DL QSAR Models

Interlaboratory Study Assessing the Analysis of Supercapacitor Electrochemistry Data

hplc-py: A Python Package For Rapid Peak Quantification in Complex Chromatograms

Soft Potato: an open source electrochemical simulator and toolkit

Cutting Through the Noise: Extracting Dynamics from Ultrafast Spectra using Dynamic Mode Decomposition

Machine learning-based peptide-spectrum match rescoring opens up the immunopeptidome

pyBinder: Label-free Quantitation to Advance Affinity Selection-Mass Spectrometry

iSIM: Instant Similarity

40 results in Keywords: Data Analysis