open-forcefield-group/smirff99Frosst: Version 1.0.4
| Main Authors: | David L. Mobley, Caitlin Bannan |
|---|---|
| Format: | info software Journal |
| Terbitan: |
, 2017
|
| Online Access: |
https://zenodo.org/record/348165 |
Daftar Isi:
- Fixes a minor bug where a C-OS bond length overrode a C-OH bond length, and a major bug introduced by an earlier revision where a generic torsion had been replaced by a specialized one (to fix one bug) in a way which introduced holes in the coverage of generic torsions.