clean up run - Githubissues

smog-server / OpenSMOG

OpenSMOG is a Python library for performing molecular dynamics simulations using Structure-Based Models. OpenSMOG uses OpenMM.

MIT License

11 stars 6 forks source link

Closed Whitford closed 1 month ago

Whitford commented 8 months ago

make .run simpler, so you could call it repeatedly using the same context.

Whitford commented 1 month ago

see commit bec905c