The GROMACS patch in the deepmd-kit repository has not been updated for 5 years, and it seems no one is familiar with it or willing to contribute. Thus, we decide to deprecate it. Documentation will be updated soon.
Note: there is a third-party version at https://arxiv.org/abs/2602.02234, which was claimed to be better.
The GROMACS patch in the deepmd-kit repository has not been updated for 5 years, and it seems no one is familiar with it or willing to contribute. Thus, we decide to deprecate it. Documentation will be updated soon.
Note: there is a third-party version at https://arxiv.org/abs/2602.02234, which was claimed to be better.