The SAMP1 Solvation Challenge: Further Lessons Regarding the Pitfalls of Parametrization
Author:
Affiliation:
1. OpenEye Scientific Software, Inc Santa Fe, New Mexico, USA 87508
2. AstraZeneca Pharmaceuticals, Mereside, Macclesfield, Cheshire, SK10 4TF, England
Publisher
American Chemical Society (ACS)
Subject
Materials Chemistry,Surfaces, Coatings and Films,Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp806855q
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