(Q51806309)

12 April 2018

title

Scoring ligand similarity in structure-based virtual screening. (English)

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12 April 2018

author name string

Maria I Zavodszky

1

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12 April 2018

Anjali Rohatgi

2

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12 April 2018

Jeffrey R Van Voorst

3

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12 April 2018

Honggao Yan

4

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Leslie A Kuhn

5

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publication date

1 July 2009

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12 April 2018

Journal of Molecular Recognition

published in

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12 April 2018

volume

22

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issue

4

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12 April 2018

page(s)

280-292

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12 April 2018

The Cambridge Structural Database: a quarter of a million crystal structures and rising

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The Protein Data Bank

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A Common Mechanism Underlying Promiscuous Inhibitors from Virtual and High-Throughput Screening

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A specific mechanism of nonspecific inhibition

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Efficient method for high-throughput virtual screening based on flexible docking: discovery of novel acetylcholinesterase inhibitors.

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Distilling the essential features of a protein surface for improving protein-ligand docking, scoring, and virtual screening.

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Discovering New Classes of Brugia malayi Asparaginyl-tRNA Synthetase Inhibitors and Relating Specificity to Conformational Change

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Identifiers

DOI

10.1002/JMR.942

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12 April 2018

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12 April 2018