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Drug Discovery Today. Technologies
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September 21, 2013
Combination of ligand- and structure-based methods in virtual screening
Malgorzata N Drwal, Renate Griffith
Molecular Informatics
|
July 11, 2017
Multi-target Fragments Display Versatile Binding Modes
Malgorzata N Drwal, Guillaume Bret, Esther Kellenberger
Journal of Computer-Aided Molecular Design
|
December 3, 2013
Development of purely structure-based pharmacophores for the topoisomerase I-DNA-ligand binding pocket
Malgorzata N Drwal, Keli Agama, Yves Pommier, et al.
Natural Products and Bioprospecting
|
January 25, 2016
Inhibition of DNA-Topoisomerase I by Acylated Triterpene Saponins from Pittosporum angustifolium Lodd
Christian Bäcker, Malgorzata N Drwal, Robert Preissner, et al.
Journal of Cheminformatics
|
March 24, 2019
Binding mode information improves fragment docking
Célien Jacquemard, Malgorzata N Drwal, Jérémy Desaphy, et al.
Journal of Cheminformatics
|
March 21, 2017
Computational methods for prediction of in vitro effects of new chemical structures
Priyanka Banerjee, Vishal B Siramshetty, Malgorzata N Drwal, et al.
Journal of Chemical Information and Modeling
|
April 18, 2017
Do Fragments and Crystallization Additives Bind Similarly to Drug-like Ligands?
Malgorzata N Drwal, Célien Jacquemard, Carlos Perez, et al.
Nucleic Acids Research
|
May 20, 2014
ProTox: a web server for the in silico prediction of rodent oral toxicity
Malgorzata N Drwal, Priyanka Banerjee, Mathias Dunkel, et al.
Plos One
|
October 4, 2011
Exploring DNA topoisomerase I ligand space in search of novel anticancer agents
Malgorzata N Drwal, Keli Agama, Laurence P G Wakelin, et al.
Molecules (Basel, Switzerland)
|
July 21, 2019
Local Interaction Density (LID), a Fast and Efficient Tool to Prioritize Docking Poses
Célien Jacquemard, Viet-Khoa Tran-Nguyen, Malgorzata N Drwal, et al.
Page
of 2
Search research articles
Search
Showing results (1-10 of 14) with videos related to
Sort By:
Page
of 2
Drug Discovery Today. Technologies
|
September 21, 2013
Combination of ligand- and structure-based methods in virtual screening
Malgorzata N Drwal, Renate Griffith
Molecular Informatics
|
July 11, 2017
Multi-target Fragments Display Versatile Binding Modes
Malgorzata N Drwal, Guillaume Bret, Esther Kellenberger
Journal of Computer-Aided Molecular Design
|
December 3, 2013
Development of purely structure-based pharmacophores for the topoisomerase I-DNA-ligand binding pocket
Malgorzata N Drwal, Keli Agama, Yves Pommier, et al.
Natural Products and Bioprospecting
|
January 25, 2016
Inhibition of DNA-Topoisomerase I by Acylated Triterpene Saponins from Pittosporum angustifolium Lodd
Christian Bäcker, Malgorzata N Drwal, Robert Preissner, et al.
Journal of Cheminformatics
|
March 24, 2019
Binding mode information improves fragment docking
Célien Jacquemard, Malgorzata N Drwal, Jérémy Desaphy, et al.
Journal of Cheminformatics
|
March 21, 2017
Computational methods for prediction of in vitro effects of new chemical structures
Priyanka Banerjee, Vishal B Siramshetty, Malgorzata N Drwal, et al.
Journal of Chemical Information and Modeling
|
April 18, 2017
Do Fragments and Crystallization Additives Bind Similarly to Drug-like Ligands?
Malgorzata N Drwal, Célien Jacquemard, Carlos Perez, et al.
Nucleic Acids Research
|
May 20, 2014
ProTox: a web server for the in silico prediction of rodent oral toxicity
Malgorzata N Drwal, Priyanka Banerjee, Mathias Dunkel, et al.
Plos One
|
October 4, 2011
Exploring DNA topoisomerase I ligand space in search of novel anticancer agents
Malgorzata N Drwal, Keli Agama, Laurence P G Wakelin, et al.
Molecules (Basel, Switzerland)
|
July 21, 2019
Local Interaction Density (LID), a Fast and Efficient Tool to Prioritize Docking Poses
Célien Jacquemard, Viet-Khoa Tran-Nguyen, Malgorzata N Drwal, et al.
Page
of 2