Add iPython Notebooks which make a version of FreeSolv attached to OEMols

MobleyLab / FreeSolv

Experimental and calculated small molecule hydration free energies

http://www.escholarship.org/uc/item/6sd403pz

101 stars 53 forks source link

Closed nathanmlim closed 7 years ago

nathanmlim commented 7 years ago

Added a directory for iPython notebooks and provided an example of concatenating molecules and associating generic data.