Supplement Number 1

https://doi.org/10.60893/figshare.jcp.28137941

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posted on 2025-01-27, 05:08 authored by Andres Urbina, Lyudmila Slipchenko

Supplementary materials including computational details and other supporting information

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DOI - Is supplement to Rationalizing Protein-Ligand Interactions via the Effective Fragment Potential Method and Structural Data from Classical Molecular Dynamics

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Chemical sciences

Keywords

molecular dynamics effective fragment potential CDK2 protein-ligand interactions

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