Commit History

Autor SHA1 Mensaxe Data
  JonStargaryen 207c226f66 naming %!s(int64=4) %!d(string=hai) anos
  JonStargaryen 8471d337a2 add protvar atoms to cca.bcif %!s(int64=4) %!d(string=hai) anos
  Alexander Rose 17162e967a fix create-ion, add chem-comp-dict util %!s(int64=4) %!d(string=hai) anos
  McMenemy 5be6c9176a move to separate script %!s(int64=4) %!d(string=hai) anos
  McMenemy f293a02485 better arg help text %!s(int64=4) %!d(string=hai) anos
  McMenemy 0a30ed45f9 first pass working extracting ion names %!s(int64=4) %!d(string=hai) anos
  JonStargaryen 3aa9ef7595 rename chem_comp_bond to chem_comp_dict %!s(int64=4) %!d(string=hai) anos