Search Result "virtual screening of chemical libraries"


Approaches to Virtual Screening and Screening Library Selection

Journal: Current Pharmaceutical Design
Volume: 19 Issue: 26 Year: 2013 Page: 4787-4796
Author(s): Scott A. Wildman

Development of Chemical Compound Libraries for In Silico Drug Screening

Journal: Current Computer-Aided Drug Design
Volume: 6 Issue: 2 Year: 2010 Page: 90-102
Author(s): Yoshifumi Fukunishi, Masami Lintuluoto

Chemical Libraries for Virtual Screening

Ebook: In Silico Lead Discovery
Volume: 1 Year: 2011
Author(s): David Lagorce,Olivier Sperandio,Maria A. Miteva,Bruno O. Villoutreix
Doi: 10.2174/978160805142711101010001

Library Design for Fragment Based Screening

Journal: Current Topics in Medicinal Chemistry
Volume: 5 Issue: 8 Year: 2005 Page: 751-762
Author(s): Ansgar Schuffenhauer, Simon Ruedisser, Andreas Marzinzik, Wolfgang Jahnke, Paul Selzer, Edgar Jacoby

Scalable Methods for the Construction and Analysis of Virtual Combinatorial Libraries

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 5 Issue: 2 Year: 2002 Page: 167-178
Author(s): Victor S. Lobanov, Dimitris K. Agrafiotis

Integrating Virtual Screening and Combinatorial Chemistry for Accelerated Drug Discovery

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 14 Issue: 6 Year: 2011 Page: 475-487
Author(s): Fabian Lopez-Vallejo, Thomas Caulfield, Karina Martinez-Mayorga, Marc A. Giulianotti, Adel Nefzi, Richard A. Houghten, Jose L. Medina-Franco

3D Pharmacophore Based Virtual Screening of A2A Adenosine Receptor Antagonists

Journal: Protein & Peptide Letters
Volume: 17 Issue: 3 Year: 2010 Page: 332-339
Author(s): Jing Wei, Wanlu Qu, Yingda Ye, Qingzhi Gao

A Pseudo-Ligand Approach to Virtual Screening

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 9 Issue: 5 Year: 2006 Page: 359-364
Author(s): Andreas Schuller, Uli Fechner, Steffen Renner, Lutz Franke, Lutz Weber, Gisbert Schneider

ChemScreener: A Distributed Computing Tool for Scaffold based Virtual Screening

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 18 Issue: 6 Year: 2015 Page: 544-561
Author(s): Muthukumarasamy Karthikeyan,Deepak Pandit,Renu Vyas

Optimization of Focused Chemical Libraries Using Recursive Partitioning

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 5 Issue: 2 Year: 2002 Page: 125-133
Author(s): Andrew Rusinko lll, S. Stanley Young, David H. Drewry, Sam W. Gerritz

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