Molecular dynamics simulation trajectories for the GB99dms implicit solvent force field
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资源简介：
Molecular dynamics simulation trajectories used in training and validating the GB99dms implicit solvent protein force field. See the paper: Greener JG. Differentiable simulation to develop molecular dynamics force fields for disordered proteins, Chemical Science 15, 4897-4909 (2024) For more information, including structure files for these trajectories, see https://github.com/greener-group/GB99dms.
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Zenodo创建时间：
2023-08-29
