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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) cofactors
Ilenia Giangreco, Martin J Packer
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 Methods
Ilenia Giangreco, Abhik Mukhopadhyay, Jason C Cole
Progress in Medicinal Chemistry
|
June 20, 2021
Use of molecular docking computational tools in drug discovery
Francesca Stanzione, Ilenia Giangreco, Jason C Cole
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 analysis
Jason C Cole, Ilenia Giangreco, Colin R Groom
Acta 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. Addendum
Jason C Cole, Ilenia Giangreco, Colin R Groom
Journal of Chemical Information and Modeling
|
April 10, 2013
An extensive and diverse set of molecular overlays for the validation of pharmacophore programs
Ilenia Giangreco, David A Cosgrove, Martin J Packer
Journal of Chemical Information and Modeling
|
September 30, 2009
Improving quantitative structure-activity relationships through multiobjective optimization
Orazio Nicolotti, Ilenia Giangreco, Teresa Fabiola Miscioscia, et al.
Journal of Cheminformatics
|
December 22, 2023
Applying atomistic neural networks to bias conformer ensembles towards bioactive-like conformations
Benoit Baillif, Jason Cole, Ilenia Giangreco, et al.
Journal of Medicinal Chemistry
|
June 30, 2016
Protein-Ligand Informatics Force Field (PLIff): Toward a Fully Knowledge Driven "Force Field" for Biomolecular Interactions
Marcel L Verdonk, R Frederick Ludlow, Ilenia Giangreco, et al.
Journal of Chemical Information and Modeling
|
November 14, 2014
Assessment of a Cambridge Structural Database-driven overlay program
Ilenia Giangreco, Tjelvar S G Olsson, Jason C Cole, et al.
Page
of 2
Search research articles
Search
Showing results (1-10 of 19) with videos related to
Sort By:
Page
of 2
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) cofactors
Ilenia Giangreco, Martin J Packer
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 Methods
Ilenia Giangreco, Abhik Mukhopadhyay, Jason C Cole
Progress in Medicinal Chemistry
|
June 20, 2021
Use of molecular docking computational tools in drug discovery
Francesca Stanzione, Ilenia Giangreco, Jason C Cole
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 analysis
Jason C Cole, Ilenia Giangreco, Colin R Groom
Acta 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. Addendum
Jason C Cole, Ilenia Giangreco, Colin R Groom
Journal of Chemical Information and Modeling
|
April 10, 2013
An extensive and diverse set of molecular overlays for the validation of pharmacophore programs
Ilenia Giangreco, David A Cosgrove, Martin J Packer
Journal of Chemical Information and Modeling
|
September 30, 2009
Improving quantitative structure-activity relationships through multiobjective optimization
Orazio Nicolotti, Ilenia Giangreco, Teresa Fabiola Miscioscia, et al.
Journal of Cheminformatics
|
December 22, 2023
Applying atomistic neural networks to bias conformer ensembles towards bioactive-like conformations
Benoit Baillif, Jason Cole, Ilenia Giangreco, et al.
Journal of Medicinal Chemistry
|
June 30, 2016
Protein-Ligand Informatics Force Field (PLIff): Toward a Fully Knowledge Driven "Force Field" for Biomolecular Interactions
Marcel L Verdonk, R Frederick Ludlow, Ilenia Giangreco, et al.
Journal of Chemical Information and Modeling
|
November 14, 2014
Assessment of a Cambridge Structural Database-driven overlay program
Ilenia Giangreco, Tjelvar S G Olsson, Jason C Cole, et al.
Page
of 2