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Peter Willett

Showing results (91-100 of 100) with videos related to

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Journal of Medicinal Chemistry|October 28, 2005
Enhancing the effectiveness of similarity-based virtual screening using nearest-neighbor informationJérôme Hert, Peter Willett, David J Wilton, et al.
Nucleic Acids Research|May 17, 2014
COGNAC: a web server for searching and annotating hydrogen-bonded base interactions in RNA three-dimensional structuresMohd Firdaus-Raih, Hazrina Yusof Hamdani, Nurul Nadzirin, et al.
Journal of Chemical Information and Computer Sciences|May 25, 2004
Clustering files of chemical structures using the fuzzy k-means clustering methodJohn D Holliday, Sarah L Rodgers, Peter Willett, et al.
Journal of Computer-Aided Molecular Design|October 20, 2006
GALAHAD: 1. pharmacophore identification by hypermolecular alignment of ligands in 3DNicola J Richmond, Charlene A Abrams, Philippa R N Wolohan, et al.
Journal of Chemical Information and Modeling|March 28, 2006
Scaffold hopping using clique detection applied to reduced graphsEdward J Barker, David Buttar, David A Cosgrove, et al.
Journal of Chemical Information and Modeling|March 28, 2006
Virtual screening using binary kernel discrimination: effect of noisy training data and the optimization of performanceBeining Chen, Robert F Harrison, Kitsuchart Pasupa, et al.
Journal of Computer-Aided Molecular Design|January 6, 2007
Evaluation of machine-learning methods for ligand-based virtual screeningBeining Chen, Robert F Harrison, George Papadatos, et al.
Journal of Chemical Information and Modeling|May 13, 2009
Analysis of neighborhood behavior in lead optimization and array designGeorge Papadatos, Anthony W J Cooper, Visakan Kadirkamanathan, et al.
Journal of Chemical Information and Modeling|September 30, 2010
Lead optimization using matched molecular pairs: inclusion of contextual information for enhanced prediction of HERG inhibition, solubility, and lipophilicityGeorge Papadatos, Muhammad Alkarouri, Valerie J Gillet, et al.
Future Medicinal Chemistry|June 29, 2011
Ask the experts: focus on computational chemistryJürgen Bajorath, Maria Letizia Barreca, Andreas Bender, et al.
Pageof 10

Showing results (91-100 of 100) with videos related to

Sort By:
Pageof 10
You have reached the last page of results.This site can display upto 100 results.
Journal of Medicinal Chemistry|October 28, 2005
Enhancing the effectiveness of similarity-based virtual screening using nearest-neighbor informationJérôme Hert, Peter Willett, David J Wilton, et al.
Nucleic Acids Research|May 17, 2014
COGNAC: a web server for searching and annotating hydrogen-bonded base interactions in RNA three-dimensional structuresMohd Firdaus-Raih, Hazrina Yusof Hamdani, Nurul Nadzirin, et al.
Journal of Chemical Information and Computer Sciences|May 25, 2004
Clustering files of chemical structures using the fuzzy k-means clustering methodJohn D Holliday, Sarah L Rodgers, Peter Willett, et al.
Journal of Computer-Aided Molecular Design|October 20, 2006
GALAHAD: 1. pharmacophore identification by hypermolecular alignment of ligands in 3DNicola J Richmond, Charlene A Abrams, Philippa R N Wolohan, et al.
Journal of Chemical Information and Modeling|March 28, 2006
Scaffold hopping using clique detection applied to reduced graphsEdward J Barker, David Buttar, David A Cosgrove, et al.
Journal of Chemical Information and Modeling|March 28, 2006
Virtual screening using binary kernel discrimination: effect of noisy training data and the optimization of performanceBeining Chen, Robert F Harrison, Kitsuchart Pasupa, et al.
Journal of Computer-Aided Molecular Design|January 6, 2007
Evaluation of machine-learning methods for ligand-based virtual screeningBeining Chen, Robert F Harrison, George Papadatos, et al.
Journal of Chemical Information and Modeling|May 13, 2009
Analysis of neighborhood behavior in lead optimization and array designGeorge Papadatos, Anthony W J Cooper, Visakan Kadirkamanathan, et al.
Journal of Chemical Information and Modeling|September 30, 2010
Lead optimization using matched molecular pairs: inclusion of contextual information for enhanced prediction of HERG inhibition, solubility, and lipophilicityGeorge Papadatos, Muhammad Alkarouri, Valerie J Gillet, et al.
Future Medicinal Chemistry|June 29, 2011
Ask the experts: focus on computational chemistryJürgen Bajorath, Maria Letizia Barreca, Andreas Bender, et al.
Pageof 10