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Marcel L Verdonk

Showing results (1-10 of 30) with videos related to

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Current Opinion in Drug Discovery & Development|September 2, 2004
Structure-guided fragment screening for lead discoveryMarcel L Verdonk, Michael J Hartshorn
Chemmedchem|July 25, 2008
Group efficiency: a guideline for hits-to-leads chemistryMarcel L Verdonk, David C Rees
Journal of Computer-Aided Molecular Design|March 26, 2003
The consequences of translational and rotational entropy lost by small molecules on binding to proteinsChristopher W Murray, Marcel L Verdonk
Proteins|August 18, 2005
General and targeted statistical potentials for protein-ligand interactionsWijnand T M Mooij, Marcel L Verdonk
Journal of Medicinal Chemistry|December 8, 2006
Protein-ligand binding affinity predictions by implicit solvent simulations: a tool for lead optimization?Julien Michel, Marcel L Verdonk, Jonathan W Essex
Journal of Chemical Theory and Computation|December 3, 2015
Protein-Ligand Complexes:  Computation of the Relative Free Energy of Different Scaffolds and Binding ModesJulien Michel, Marcel L Verdonk, Jonathan W Essex
Trends in Pharmacological Sciences|March 31, 2012
Experiences in fragment-based drug discoveryChristopher W Murray, Marcel L Verdonk, David C Rees
Journal of Medicinal Chemistry|July 18, 2017
The Fragment Network: A Chemistry Recommendation Engine Built Using a Graph DatabaseRichard J Hall, Christopher W Murray, Marcel L Verdonk
Journal of Medicinal Chemistry|September 26, 2019
Practical High-Quality Electrostatic Potential Surfaces for Drug Discovery Using a Graph-Convolutional Deep Neural NetworkPrakash Chandra Rathi, R Frederick Ludlow, Marcel L Verdonk
Journal of Medicinal Chemistry|June 30, 2016
Protein-Ligand Informatics Force Field (PLIff): Toward a Fully Knowledge Driven "Force Field" for Biomolecular InteractionsMarcel L Verdonk, R Frederick Ludlow, Ilenia Giangreco, et al.
Pageof 3

Showing results (1-10 of 30) with videos related to

Sort By:
Pageof 3
Current Opinion in Drug Discovery & Development|September 2, 2004
Structure-guided fragment screening for lead discoveryMarcel L Verdonk, Michael J Hartshorn
Chemmedchem|July 25, 2008
Group efficiency: a guideline for hits-to-leads chemistryMarcel L Verdonk, David C Rees
Journal of Computer-Aided Molecular Design|March 26, 2003
The consequences of translational and rotational entropy lost by small molecules on binding to proteinsChristopher W Murray, Marcel L Verdonk
Proteins|August 18, 2005
General and targeted statistical potentials for protein-ligand interactionsWijnand T M Mooij, Marcel L Verdonk
Journal of Medicinal Chemistry|December 8, 2006
Protein-ligand binding affinity predictions by implicit solvent simulations: a tool for lead optimization?Julien Michel, Marcel L Verdonk, Jonathan W Essex
Journal of Chemical Theory and Computation|December 3, 2015
Protein-Ligand Complexes:  Computation of the Relative Free Energy of Different Scaffolds and Binding ModesJulien Michel, Marcel L Verdonk, Jonathan W Essex
Trends in Pharmacological Sciences|March 31, 2012
Experiences in fragment-based drug discoveryChristopher W Murray, Marcel L Verdonk, David C Rees
Journal of Medicinal Chemistry|July 18, 2017
The Fragment Network: A Chemistry Recommendation Engine Built Using a Graph DatabaseRichard J Hall, Christopher W Murray, Marcel L Verdonk
Journal of Medicinal Chemistry|September 26, 2019
Practical High-Quality Electrostatic Potential Surfaces for Drug Discovery Using a Graph-Convolutional Deep Neural NetworkPrakash Chandra Rathi, R Frederick Ludlow, Marcel L Verdonk
Journal of Medicinal Chemistry|June 30, 2016
Protein-Ligand Informatics Force Field (PLIff): Toward a Fully Knowledge Driven "Force Field" for Biomolecular InteractionsMarcel L Verdonk, R Frederick Ludlow, Ilenia Giangreco, et al.
Pageof 3