Molecular dynamics simulation trajectories for the GB99dms implicit solvent force field

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.