ChangeLog

This document aims to track all the notable changes to the FFEA project.

The format is based on Keep a Changelog and this project adheres to Semantic Versioning.

2.6.0 - 2017-11-28

Added

• Performance significantly improved for the PyMOL plugin.
• New short range potential introduced, see General Soft Potential.
• ChangeLog introduced.

Changed

• Keyword calc_vdw has been changed to calc_ssint, the new name reflecting that they are surface-surface interactions.
• Keyword calc_steric was introduced, to make possible the combination of surface-surface interactions with steric interactions, without constantly extending the entries for keyword ssint_type.

Deprecated

• Using vdw instead of ssint in keywords is deprecated. This way, calc_vdw should be calc_ssint, vdw_type should be ssint_type, vdw_in_fname should be ssint_in_fname, et cetera.