diff --git a/CHANGELOG.txt b/CHANGELOG.txt index 94c1d528ce7c5404c6f25a16251c541ccfe2d8e2..1bdbebe9160198a26aaa47d9631dd21ceec0d18b 100644 --- a/CHANGELOG.txt +++ b/CHANGELOG.txt @@ -1,10 +1,13 @@ Changes in Release 1.5 -------------------------------------------------------------------------------- + * Wrapper for OpenMM. This allows for direct access to molecular + mechanics functionality from within OST. * The compoundslib now features InChI and InChIKeys (machine readable InChI hash) * Names of compounds are also stored in the compoundslib now + Changes in Release 1.4 --------------------------------------------------------------------------------