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Marcel L Verdonk

Showing results (11-20 of 30) with videos related to

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Nature Genetics|August 31, 2018
COSMIC-3D provides structural perspectives on cancer genetics for drug discoveryHarry C Jubb, Harpreet K Saini, Marcel L Verdonk, et al.
Proteins|January 15, 2005
Prediction of binding modes for ligands in the cytochromes P450 and other heme-containing proteinsStewart B Kirton, Christopher W Murray, Marcel L Verdonk, et al.
Proceedings of the National Academy of Sciences of the United States of America|December 15, 2015
Detection of secondary binding sites in proteins using fragment screeningR Frederick Ludlow, Marcel L Verdonk, Harpreet K Saini, et al.
Journal of Computer-Aided Molecular Design|June 27, 2003
Sensitivity of molecular docking to induced fit effects in influenza virus neuraminidaseLouise Birch, Christopher W Murray, Michael J Hartshorn, et al.
Proteins|August 12, 2003
Improved protein-ligand docking using GOLDMarcel L Verdonk, Jason C Cole, Michael J Hartshorn, et al.
Journal of Chemical Information and Modeling|October 29, 2008
Protein-ligand docking against non-native protein conformersMarcel L Verdonk, Paul N Mortenson, Richard J Hall, et al.
Journal of Medicinal Chemistry|June 23, 2011
Docking performance of fragments and druglike compoundsMarcel L Verdonk, Ilenia Giangreco, Richard J Hall, et al.
Proteins|October 29, 2002
A new test set for validating predictions of protein-ligand interactionJ Willem M Nissink, Chris Murray, Mike Hartshorn, et al.
Nature Communications|July 4, 2025
Accelerating fragment-based drug discovery using grand canonical nonequilibrium candidate Monte CarloWilliam G Poole, Marley L Samways, Davide Branduardi, et al.
Journal of Chemical Information and Modeling|March 22, 2021
ParaMol: A Package for Automatic Parameterization of Molecular Mechanics Force FieldsJoão Morado, Paul N Mortenson, Marcel L Verdonk, et al.
Pageof 3

Showing results (11-20 of 30) with videos related to

Sort By:
Pageof 3
Nature Genetics|August 31, 2018
COSMIC-3D provides structural perspectives on cancer genetics for drug discoveryHarry C Jubb, Harpreet K Saini, Marcel L Verdonk, et al.
Proteins|January 15, 2005
Prediction of binding modes for ligands in the cytochromes P450 and other heme-containing proteinsStewart B Kirton, Christopher W Murray, Marcel L Verdonk, et al.
Proceedings of the National Academy of Sciences of the United States of America|December 15, 2015
Detection of secondary binding sites in proteins using fragment screeningR Frederick Ludlow, Marcel L Verdonk, Harpreet K Saini, et al.
Journal of Computer-Aided Molecular Design|June 27, 2003
Sensitivity of molecular docking to induced fit effects in influenza virus neuraminidaseLouise Birch, Christopher W Murray, Michael J Hartshorn, et al.
Proteins|August 12, 2003
Improved protein-ligand docking using GOLDMarcel L Verdonk, Jason C Cole, Michael J Hartshorn, et al.
Journal of Chemical Information and Modeling|October 29, 2008
Protein-ligand docking against non-native protein conformersMarcel L Verdonk, Paul N Mortenson, Richard J Hall, et al.
Journal of Medicinal Chemistry|June 23, 2011
Docking performance of fragments and druglike compoundsMarcel L Verdonk, Ilenia Giangreco, Richard J Hall, et al.
Proteins|October 29, 2002
A new test set for validating predictions of protein-ligand interactionJ Willem M Nissink, Chris Murray, Mike Hartshorn, et al.
Nature Communications|July 4, 2025
Accelerating fragment-based drug discovery using grand canonical nonequilibrium candidate Monte CarloWilliam G Poole, Marley L Samways, Davide Branduardi, et al.
Journal of Chemical Information and Modeling|March 22, 2021
ParaMol: A Package for Automatic Parameterization of Molecular Mechanics Force FieldsJoão Morado, Paul N Mortenson, Marcel L Verdonk, et al.
Pageof 3