Solvent sites detection from molecular dynamics in mixed solvents
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In this zip file, you will find 3 molecular dynamics (MDs) that were run using the AMBER molecular dynamics package (https://ambermd.org/), and the necessary scripts to obtain the solvent sites. The MDs correspond to the kinase and rubredoxin domains of protein kinase G from Mycobacterium tuberculosis.
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Zenodo创建时间：
2021-11-05
