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David A Cosgrove

Showing results (1-10 of 18) with videos related to

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Journal of Chemical Information and Modeling|April 10, 2013
An extensive and diverse set of molecular overlays for the validation of pharmacophore programsIlenia Giangreco, David A Cosgrove, Martin J Packer
Journal of Chemical Information and Modeling|March 31, 2018
ReFlex3D: Refined Flexible Alignment of Molecules Using Shape and ElectrostaticsThomas C Schmidt, David A Cosgrove, Jonas Boström
Chemmedchem|January 10, 2018
Bioisosteric Replacements Extracted from High-Quality Structures in the Protein DatabankMatthew P Seddon, David A Cosgrove, Valerie J Gillet
Journal of Computer-Aided Molecular Design|March 14, 2009
Design of compound libraries for fragment screeningNiklas Blomberg, David A Cosgrove, Peter W Kenny, et al.
Journal of Chemical Information and Modeling|November 8, 2014
Investigation of the use of spectral clustering for the analysis of molecular dataSonny Gan, David A Cosgrove, Eleanor J Gardiner, et al.
Journal of Chemical Information and Modeling|February 21, 2007
Representing clusters using a maximum common edge substructure algorithm applied to reduced graphs and molecular graphsEleanor J Gardiner, Valerie J Gillet, Peter Willett, et al.
Journal of Chemical Information and Modeling|November 14, 2009
Multiobjective optimization of pharmacophore hypotheses: bias toward low-energy conformationsEleanor J Gardiner, David A Cosgrove, Robin Taylor, et al.
Journal of Chemical Information and Modeling|November 22, 2018
Alignment-Free Molecular Shape Comparison Using Spectral Geometry: The FrameworkMatthew P Seddon, David A Cosgrove, Martin J Packer, et al.
Journal of Chemical Information and Modeling|July 28, 2005
Lead hopping using SVM and 3D pharmacophore fingerprintsJamal C Saeh, Paul D Lyne, Bryan K Takasaki, et al.
Journal of Chemical Information and Modeling|July 19, 2012
A system for encoding and searching Markush structuresDavid A Cosgrove, Keith M Green, Andrew G Leach, et al.
Pageof 2

Showing results (1-10 of 18) with videos related to

Sort By:
Pageof 2
Journal of Chemical Information and Modeling|April 10, 2013
An extensive and diverse set of molecular overlays for the validation of pharmacophore programsIlenia Giangreco, David A Cosgrove, Martin J Packer
Journal of Chemical Information and Modeling|March 31, 2018
ReFlex3D: Refined Flexible Alignment of Molecules Using Shape and ElectrostaticsThomas C Schmidt, David A Cosgrove, Jonas Boström
Chemmedchem|January 10, 2018
Bioisosteric Replacements Extracted from High-Quality Structures in the Protein DatabankMatthew P Seddon, David A Cosgrove, Valerie J Gillet
Journal of Computer-Aided Molecular Design|March 14, 2009
Design of compound libraries for fragment screeningNiklas Blomberg, David A Cosgrove, Peter W Kenny, et al.
Journal of Chemical Information and Modeling|November 8, 2014
Investigation of the use of spectral clustering for the analysis of molecular dataSonny Gan, David A Cosgrove, Eleanor J Gardiner, et al.
Journal of Chemical Information and Modeling|February 21, 2007
Representing clusters using a maximum common edge substructure algorithm applied to reduced graphs and molecular graphsEleanor J Gardiner, Valerie J Gillet, Peter Willett, et al.
Journal of Chemical Information and Modeling|November 14, 2009
Multiobjective optimization of pharmacophore hypotheses: bias toward low-energy conformationsEleanor J Gardiner, David A Cosgrove, Robin Taylor, et al.
Journal of Chemical Information and Modeling|November 22, 2018
Alignment-Free Molecular Shape Comparison Using Spectral Geometry: The FrameworkMatthew P Seddon, David A Cosgrove, Martin J Packer, et al.
Journal of Chemical Information and Modeling|July 28, 2005
Lead hopping using SVM and 3D pharmacophore fingerprintsJamal C Saeh, Paul D Lyne, Bryan K Takasaki, et al.
Journal of Chemical Information and Modeling|July 19, 2012
A system for encoding and searching Markush structuresDavid A Cosgrove, Keith M Green, Andrew G Leach, et al.
Pageof 2