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Free energy calculations in molecular modeling: from classical methods to machine learning

Crossref DOI link: https://doi.org/10.1007/s00894-026-06678-8

Published Online: 2026-03-28

Published Print: 2026-04

Update policy: https://doi.org/10.1007/springer_crossmark_policy

Authors

Purohit, Apoorva https://orcid.org/0000-0003-0664-6972
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Text and Data Mining valid from 2026-03-28

Version of Record valid from 2026-03-28
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Article History

Received: 25 September 2025

Accepted: 24 February 2026

First Online: 28 March 2026

Declarations

:

: The authors declare no competing interests.