Showing results (1-10 of 90) with videos related to
Sort By:
Pageof 9
Acta Crystallographica. Section D, Structural Biology|March 15, 2017
Using more than 801 296 small-molecule crystal structures to aid in protein structure refinement and analysisJason C Cole, Ilenia Giangreco, Colin R GroomActa Crystallographica. Section D, Structural Biology|December 5, 2017
Using more than 801 296 small-molecule crystal structures to aid in protein structure refinement and analysis. AddendumJason C Cole, Ilenia Giangreco, Colin R GroomActa Crystallographica Section B, Structural Science, Crystal Engineering and Materials|August 4, 2016
Generation of crystal structures using known crystal structures as analoguesJason C Cole, Colin R Groom, Murray G Read, et al.Journal of Chemical Information and Modeling|November 18, 2021
Validation of a Field-Based Ligand Screener Using a Novel Benchmarking Data Set for Assessing 3D-Based Virtual Screening MethodsIlenia Giangreco, Abhik Mukhopadhyay, Jason C ColeProgress in Medicinal Chemistry|June 20, 2021
Use of molecular docking computational tools in drug discoveryFrancesca Stanzione, Ilenia Giangreco, Jason C ColeActa Crystallographica. Section D, Structural Biology|March 15, 2017
The use of small-molecule structures to complement protein-ligand crystal structures in drug discoveryColin R Groom, Jason C ColeJournal of Chemical Information and Modeling|November 14, 2014
Assessment of a Cambridge Structural Database-driven overlay programIlenia Giangreco, Tjelvar S G Olsson, Jason C Cole, et al.Journal of Chemical Information and Modeling|March 16, 2016
Knowledge-Based Optimization of Molecular Geometries Using Crystal StructuresJason C Cole, Colin R Groom, Oliver Korb, et al.Journal of Medicinal Chemistry|July 30, 2013
Pharmacophore binding motifs for nicotinamide adenine dinucleotide analogues across multiple protein families: a detailed contact-based analysis of the interaction between proteins and NAD(P) cofactorsIlenia Giangreco, Martin J PackerJournal 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 PackerPageof 9