"Espaloma-0.3.0: Machine-learned molecular mechanics force field for the ..."

Kenichiro Takaba et al. (2023)

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DOI: 10.48550/ARXIV.2307.07085

access: open

type: Informal or Other Publication

metadata version: 2023-07-27

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  - https://dblp.org/rec/journals/corr/abs-2307-07085
Kenichiro Takaba, Iván Pulido, Mike Henry, Hugo MacDermott-Opeskin, John D. Chodera, Yuanqing Wang:
Espaloma-0.3.0: Machine-learned molecular mechanics force field for the simulation of protein-ligand systems and beyond. CoRR abs/2307.07085 (2023)

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