atom-typing

There are 0 repository under atom-typing topic.

• mosdef-hub / foyer

  A package for atom-typing as well as applying and disseminating forcefields

  molecular-dynamicsmolecular-simulationforce-fieldpythonatom-typingfoyerdisseminating-forcefields
  Language:Python 114

• nlesc-nano / MATCH

  An unofficial redistribution of the Multipurpose Atom-Typer for CHARMM (MATCH) program

  force-fieldsatom-typingmolecular-graphpartial-chargesparameterizationchemistryperl
  Language:Rich Text Format