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Journal of Computer-Aided Molecular Design
|
August 14, 2019
Diversifying chemical libraries with generative topographic mapping
Arkadii Lin, Bernd Beck, Dragos Horvath, et al.
Molecules (Basel, Switzerland)
|
May 22, 2015
S4MPLE--Sampler for Multiple Protein-Ligand Entities: Methodology and Rigid-Site Docking Benchmarking
Laurent Hoffer, Camelia Chira, Gilles Marcou, et al.
Journal of Cheminformatics
|
October 26, 2022
Implementation of a soft grading system for chemistry in a Moodle plugin
Louis Plyer, Gilles Marcou, Céline Perves, et al.
Bioorganic & Medicinal Chemistry
|
May 19, 2012
Using self-organizing maps to accelerate similarity search
Fanny Bonachera, Gilles Marcou, Natalia Kireeva, et al.
Journal of Computer-Aided Molecular Design
|
November 14, 2015
Mappability of drug-like space: towards a polypharmacologically competent map of drug-relevant compounds
Pavel Sidorov, Helena Gaspar, Gilles Marcou, et al.
Molecular Informatics
|
February 22, 2024
Predicting S. aureus antimicrobial resistance with interpretable genomic space maps
Karina Pikalyova, Alexey Orlov, Dragos Horvath, et al.
Journal of Computer-Aided Molecular Design
|
February 11, 2019
Multi-task generative topographic mapping in virtual screening
Arkadii Lin, Dragos Horvath, Gilles Marcou, et al.
RSC Medicinal Chemistry
|
April 18, 2022
Comprehensive analysis of commercial fragment libraries
Julia Revillo Imbernon, Célien Jacquemard, Guillaume Bret, et al.
Journal of Computer-Aided Molecular Design
|
April 29, 2014
Computational chemogenomics: is it more than inductive transfer?
J B Brown, Yasushi Okuno, Gilles Marcou, et al.
Molecular Informatics
|
May 12, 2018
AntiMalarial Mode of Action (AMMA) Database: Data Selection, Verification and Chemical Space Analysis
Pavel Sidorov, Elisabeth Davioud-Charvet, Gilles Marcou, et al.
Page
of 10
Search research articles
Search
Showing results (21-30 of 94) with videos related to
Sort By:
Page
of 10
Journal of Computer-Aided Molecular Design
|
August 14, 2019
Diversifying chemical libraries with generative topographic mapping
Arkadii Lin, Bernd Beck, Dragos Horvath, et al.
Molecules (Basel, Switzerland)
|
May 22, 2015
S4MPLE--Sampler for Multiple Protein-Ligand Entities: Methodology and Rigid-Site Docking Benchmarking
Laurent Hoffer, Camelia Chira, Gilles Marcou, et al.
Journal of Cheminformatics
|
October 26, 2022
Implementation of a soft grading system for chemistry in a Moodle plugin
Louis Plyer, Gilles Marcou, Céline Perves, et al.
Bioorganic & Medicinal Chemistry
|
May 19, 2012
Using self-organizing maps to accelerate similarity search
Fanny Bonachera, Gilles Marcou, Natalia Kireeva, et al.
Journal of Computer-Aided Molecular Design
|
November 14, 2015
Mappability of drug-like space: towards a polypharmacologically competent map of drug-relevant compounds
Pavel Sidorov, Helena Gaspar, Gilles Marcou, et al.
Molecular Informatics
|
February 22, 2024
Predicting S. aureus antimicrobial resistance with interpretable genomic space maps
Karina Pikalyova, Alexey Orlov, Dragos Horvath, et al.
Journal of Computer-Aided Molecular Design
|
February 11, 2019
Multi-task generative topographic mapping in virtual screening
Arkadii Lin, Dragos Horvath, Gilles Marcou, et al.
RSC Medicinal Chemistry
|
April 18, 2022
Comprehensive analysis of commercial fragment libraries
Julia Revillo Imbernon, Célien Jacquemard, Guillaume Bret, et al.
Journal of Computer-Aided Molecular Design
|
April 29, 2014
Computational chemogenomics: is it more than inductive transfer?
J B Brown, Yasushi Okuno, Gilles Marcou, et al.
Molecular Informatics
|
May 12, 2018
AntiMalarial Mode of Action (AMMA) Database: Data Selection, Verification and Chemical Space Analysis
Pavel Sidorov, Elisabeth Davioud-Charvet, Gilles Marcou, et al.
Page
of 10