Evaluation of the performance of 3D virtual screening protocols: RMSD comparisons, enrichment assessments, and decoy selection—What can we learn from earlier mistakes?-Reference-Cited by-同舟云学术

Evaluation of the performance of 3D virtual screening protocols: RMSD comparisons, enrichment assessments, and decoy selection—What can we learn from earlier mistakes?

Published:2008-01-15 Issue:3-4 Volume:22 Page:213-228
ISSN:0920-654X
Container-title:Journal of Computer-Aided Molecular Design
language:en
Short-container-title:J Comput Aided Mol Des

Author:

Kirchmair Johannes,Markt Patrick,Distinto Simona,Wolber Gerhard,Langer Thierry

Publisher

Springer Science and Business Media LLC

Subject

Physical and Theoretical Chemistry,Computer Science Applications,Drug Discovery

Link

http://link.springer.com/content/pdf/10.1007/s10822-007-9163-6.pdf

Reference90 articles.

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5. Kontoyianni M, McClellan LM, Sokol GS (2004) J Med Chem 47:558–565

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