Numerical Errors in Minimization Based Binding Energy Calculations-Reference-Cited by-同舟云学术

Numerical Errors in Minimization Based Binding Energy Calculations

Published:2012-11-28 Issue:12 Volume:52 Page:3200-3212
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Feher Miklos¹,Williams Christopher I.²

Affiliation:

1. Campbell Family Institute for Breast Cancer Research, University Health Network, Toronto Medical Discovery Tower, 101 College Street, Suite 5-361, Toronto, ON M5G 1L7, Canada

2. Chemical Computing Group, Suite 910, 1010 Sherbrooke Street West, Montreal, QC H3A 2R7, Canada

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/ci300298d

Reference41 articles.

1. Free energy calculations of protein–ligand interactions

2. Alchemical free energy methods for drug discovery: progress and challenges

3. Free energy calculations of protein–ligand interactions

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