Search Result "Fragment scoring"


Reverse Fingerprinting and Mutual Information-Based Activity Labeling and Scoring (MIBALS)

Journal: Combinatorial Chemistry & High Throughput Screening
Volume: 12 Issue: 4 Year: 2009 Page: 424-439
Author(s): Chris Williams, Suzanne K. Schreyer

Scoring Functions for Prediction of Protein-Ligand Interactions

Journal: Current Pharmaceutical Design
Volume: 19 Issue: 12 Year: 2013 Page: 2174-2182
Author(s): Jui-Chih Wang,Jung-Hsin Lin

Fragment-Based Methods for Lead Discovery

Ebook: In Silico Lead Discovery
Volume: 1 Year: 2011
Author(s): Will R. Pitt,Alicia P. Higueruelo,Nikolay P. Todorov
Doi: 10.2174/978160805142711101010060

An Adaptive Particle Swarm Optimization Algorithm for Solving DNA Fragment Assembly Problem

Journal: Current Bioinformatics
Volume: 10 Issue: 1 Year: 2015 Page: 97-105
Author(s): Indumathy Rajagopal,Uma Maheswari Sankareswaran

From Fragment Screening to Potent Binders: Strategies for Fragment-to-Lead Evolution

Journal: Mini-Reviews in Medicinal Chemistry
Volume: 9 Issue: 8 Year: 2009 Page: 956-961
Author(s): Krystian Eitner, Uwe Koch

Recent Advances in Docking and Scoring

Journal: Current Computer-Aided Drug Design
Volume: 1 Issue: 1 Year: 2005 Page: 93-102
Author(s): E. M. Krovat, T. Steindl, T. Langer

Random Molecular Fragment Methods in Computational Medicinal Chemistry

Journal: Current Medicinal Chemistry
Volume: 15 Issue: 2 Year: 2008 Page: 2108-2121
Author(s): Eugen Lounkine, Jose Batista, Jurgen Bajorath

Computational Approaches for Fragment Optimization

Journal: Current Computer-Aided Drug Design
Volume: 3 Issue: 1 Year: 2007 Page: 69-83
Author(s): Eric Vangrevelinghe, Simon Rudisser

Computational Tools for In Silico Fragment-Based Drug Design

Journal: Current Topics in Medicinal Chemistry
Volume: 12 Issue: 17 Year: 2012 Page: 1935-1943
Author(s): Jeremie Mortier,Christin Rakers,Raphael Frederick,Gerhard Wolber

The SeeDs Approach: Integrating Fragments into Drug Discovery

Journal: Current Topics in Medicinal Chemistry
Volume: 7 Issue: 1 Year: 2007 Page: 1568-1581
Author(s): Roderick E. Hubbard, Ben Davis, Ijen Chen, Martin J. Drysdale

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