Automated Discovery and Refinement of Reactive Molecular Dynamics Pathways
Author:
Affiliation:
1. SLAC Linear Accelerator Laboratory, Menlo Park, California 94025, United States
Funder
Basic Energy Sciences
Office of Naval Research
U.S. Department of Defense
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.5b00830
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