"BESMARTS: A toolkit for data-driven force field design using ..."

Trevor Gokey (2025)

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DOI: 10.21105/JOSS.06653

access: open

type: Journal Article

metadata version: 2025-07-04

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Trevor Gokey:
BESMARTS: A toolkit for data-driven force field design using binary-encoded SMARTS. J. Open Source Softw. 10(109): 6653 (2025)

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