1.0.3

Provides new force fields that use the plugin v-site handlers from smirnoff-plugins allowing v-sites to have vdW parameters and charges.

What's Changed

• Plugin v-sites update by @jthorton in #12

Full Changelog: 1.0.1...1.0.3

1.0.1

Updates to work with the newest version of interchange which removes the need for a classic LJ vdW section when using plugins.

What's Changed

• Test on 3.10 by @jthorton in #3
• Update the readme with reviewer feedback by @jthorton in #5
• Allow Python 3.11, switch to mamba-org/setup-micromamba by @mattwthompson in #6
• Updates for Interchange, non-periodic vdW methods by @mattwthompson in #7
• Remove vdW section by @mattwthompson in #10
• Update energy tests by @mattwthompson in #11
• Openmm energy tests by @jthorton in #4

New Contributors

• @mattwthompson made their first contribution in #6

Full Changelog: 1.0.0...1.0.1

1.0.0 DE-Force-1

DE-Force-1

This is the first release of the proof of concept general Double Exponential force field. See the README for details on how to install and use the force field.

What's Changed

• DE-Force-1 by @jthorton in #1

New Contributors

• @jthorton made their first contribution in #1

Full Changelog: https://github.com/jthorton/de-forcefields/commits/1.0.0