Small Molecule Conformational Preferences Derived from Crystal Structure Data. A Medicinal Chemistry Focused Analysis
Author:
Affiliation:
1. Discovery Chemistry, Roche Palo Alto LLC, Palo Alto, California, and Discovery Chemistry, F. Hoffmann-La Roche AG, Basel CH-4070, Switzerland
Publisher
American Chemical Society (ACS)
Subject
Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/ci7002494
Reference109 articles.
1. CAVEAT: A program to facilitate the design of organic molecules
2. Recore: A Fast and Versatile Method for Scaffold Hopping Based on Small Molecule Crystal Structure Conformations
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