Similarity Searching of Chemical Databases Using Atom Environment Descriptors (MOLPRINT 2D): Evaluation of Performance-Reference-Cited by-同舟云学术

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Similarity Searching of Chemical Databases Using Atom Environment Descriptors (MOLPRINT 2D): Evaluation of Performance

Published:2004-08-20 Issue:5 Volume:44 Page:1708-1718
ISSN:0095-2338
Container-title:Journal of Chemical Information and Computer Sciences
language:en
Short-container-title:J. Chem. Inf. Comput. Sci.

Author:

Bender Andreas¹,Mussa Hamse Y.¹,Glen Robert C.¹,Reiling Stephan²

Affiliation:

1. Unilever Centre for Molecular Science Informatics, Chemistry Department, University of Cambridge, Cambridge CB2 1EW, United Kingdom

2. Lead Generation Informatics, Drug Innovation & Approval (DI&A), Aventis, 1041 Route 202-206, Bridgewater, New Jersey 08807

Publisher

American Chemical Society (ACS)

Subject

Computational Theory and Mathematics,Computer Science Applications,Information Systems,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/ci0498719

Reference46 articles.

1. Virtual screening—an overview

2. Neighborhood Behavior: A Useful Concept for Validation of “Molecular Diversity” Descriptors

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