TY  - RPRT
TI  - ParFit: A Python-Based Object-Oriented Program for Fitting Molecular Mechanics Parameters to ab Initio Data
AU  - Zahariev, Federico
AU  - De Silva, Nuwan
AU  - Gordon, Mark S.
AU  - Windus, Theresa L.
AU  - Dick-Perez, Marilu
PY  - 2017
DO  - 10.1021/acs.jcim.6b00654
UR  - https://www.osti.gov/biblio/1347393
ID  - 1347393
ER  -