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Journal of Chemical Information and Modeling
|
August 22, 2020
Assessment of the Fragment Docking Program SEED
Kenneth Goossens, Berthold Wroblowski, Cassiano Langini, et al.
Drug Discovery Today
|
April 10, 2022
Corrigendum to "The European Lead Factory: An updated HTS compound library for innovative drug discovery" [Drug Discov. Today 26(10) (2021) 2406-2413]
Herman van Vlijmen, Jean-Yves Ortholand, Volkhart M-J Li, et al.
Scientific Reports
|
April 14, 2019
Application of ESMACS binding free energy protocols to diverse datasets: Bromodomain-containing protein 4
David W Wright, Shunzhou Wan, Christophe Meyer, et al.
Drug Discovery Today
|
April 23, 2021
The European Lead Factory: An updated HTS compound library for innovative drug discovery
Herman van Vlijmen, Jean-Yves Ortholand, Volkhart M-J Li, et al.
Journal of Medicinal Chemistry
|
July 30, 2011
Structure-based site of metabolism prediction for cytochrome P450 2D6
Samuel L C Moors, Ann M Vos, Maxwell D Cummings, et al.
Journal of Chemical Information and Modeling
|
January 21, 2022
The Impact of Experimental and Calculated Error on the Performance of Affinity Predictions
Gary Tresadern, Kanaka Tatikola, Javier Cabrera, et al.
Clinical Pharmacology and Therapeutics
|
July 8, 2018
Molecular Modeling of Drug-Transporter Interactions-An International Transporter Consortium Perspective
Avner Schlessinger, Matthew A Welch, Herman van Vlijmen, et al.
Molecular Informatics
|
November 9, 2017
Protocols for the Design of Kinase-focused Compound Libraries
Edgar Jacoby, Berthold Wroblowski, Christophe Buyck, et al.
Advanced Theory and Simulations
|
September 23, 2021
Application of the ESMACS Binding Free Energy Protocol to a Multi-Binding Site Lactate Dehydogenase A Ligand Dataset
David W Wright, Fouad Husseini, Shunzhou Wan, et al.
Chemical Science
|
June 4, 2021
Large scale relative protein ligand binding affinities using non-equilibrium alchemy
Vytautas Gapsys, Laura Pérez-Benito, Matteo Aldeghi, et al.
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of 5
Search research articles
Search
Showing results (11-20 of 49) with videos related to
Sort By:
Page
of 5
Journal of Chemical Information and Modeling
|
August 22, 2020
Assessment of the Fragment Docking Program SEED
Kenneth Goossens, Berthold Wroblowski, Cassiano Langini, et al.
Drug Discovery Today
|
April 10, 2022
Corrigendum to "The European Lead Factory: An updated HTS compound library for innovative drug discovery" [Drug Discov. Today 26(10) (2021) 2406-2413]
Herman van Vlijmen, Jean-Yves Ortholand, Volkhart M-J Li, et al.
Scientific Reports
|
April 14, 2019
Application of ESMACS binding free energy protocols to diverse datasets: Bromodomain-containing protein 4
David W Wright, Shunzhou Wan, Christophe Meyer, et al.
Drug Discovery Today
|
April 23, 2021
The European Lead Factory: An updated HTS compound library for innovative drug discovery
Herman van Vlijmen, Jean-Yves Ortholand, Volkhart M-J Li, et al.
Journal of Medicinal Chemistry
|
July 30, 2011
Structure-based site of metabolism prediction for cytochrome P450 2D6
Samuel L C Moors, Ann M Vos, Maxwell D Cummings, et al.
Journal of Chemical Information and Modeling
|
January 21, 2022
The Impact of Experimental and Calculated Error on the Performance of Affinity Predictions
Gary Tresadern, Kanaka Tatikola, Javier Cabrera, et al.
Clinical Pharmacology and Therapeutics
|
July 8, 2018
Molecular Modeling of Drug-Transporter Interactions-An International Transporter Consortium Perspective
Avner Schlessinger, Matthew A Welch, Herman van Vlijmen, et al.
Molecular Informatics
|
November 9, 2017
Protocols for the Design of Kinase-focused Compound Libraries
Edgar Jacoby, Berthold Wroblowski, Christophe Buyck, et al.
Advanced Theory and Simulations
|
September 23, 2021
Application of the ESMACS Binding Free Energy Protocol to a Multi-Binding Site Lactate Dehydogenase A Ligand Dataset
David W Wright, Fouad Husseini, Shunzhou Wan, et al.
Chemical Science
|
June 4, 2021
Large scale relative protein ligand binding affinities using non-equilibrium alchemy
Vytautas Gapsys, Laura Pérez-Benito, Matteo Aldeghi, et al.
Page
of 5