choderalab / espaloma_charge

Standalone charge assignment from Espaloma framework.
MIT License
38 stars 5 forks source link

Add README with training instructions to scripts/spice/ #5

Open jchodera opened 1 year ago

jchodera commented 1 year ago

We should add a README.md with detailed training instructions to scripts/spice/

yuanqing-wang commented 1 year ago

Thanks! Will do after the scripts are finalized.

mikemhenry commented 5 months ago

@yuanqing-wang are things finalized enough for some documentation?