WESTPA 2.0: High-Performance Upgrades for Weighted Ensemble Simulations and Analysis of Longer-Timescale Applications
- Publication Date:
- NSF-PAR ID:
- 10362487
- Journal Name:
- Journal of Chemical Theory and Computation
- Volume:
- 18
- Issue:
- 2
- Page Range or eLocation-ID:
- p. 638-649
- ISSN:
- 1549-9618
- Publisher:
- American Chemical Society
- Sponsoring Org:
- National Science Foundation
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