Enable extension/continuation of weight-updating REXEE simulations

wehs7661 / ensemble_md

A python package for performing GROMACS simulation ensembles

MIT License

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Closed wehs7661 closed 1 month ago

wehs7661 commented 9 months ago

The current implementation does not support extension/continuation of REXEE simulations, which should be added shortly.

wehs7661 commented 1 month ago

Closing this since @ajfriedman22 has a more detailed description in Issue #68.