There is a newer version of the record available.

Published March 1, 2018 | Version v1.0.7
Software Open

openforcefield/smirnoff99Frosst: Version 1.0.7

Creators

  • 1. University of California, Irvine
  • 2. Mobley Group, University of California, Irvine
  • 3. @MobleyLab

Description

Adds hydroxyl hydrogen LJ radii (in deviation with AMBER force fields, as per SMIRNOFF paper); also removes generic parameters.

Files

openforcefield/smirnoff99Frosst-v1.0.7.zip

Files (13.6 kB)

Name Size Download all
md5:0c72987642e5065e8eee992690703451
13.6 kB Preview Download

Additional details

Related works

Is supplement to
https://github.com/openforcefield/smirnoff99Frosst/tree/v1.0.7 (URL)