Skip to content

Latest commit

 

History

History
15 lines (11 loc) · 954 Bytes

README.md

File metadata and controls

15 lines (11 loc) · 954 Bytes

Non-Bonded Optimization and Assessment

Test Status Language grade: Python codecov License: MIT

A repository which provides a nearly automated workflow for the automated optimization and assessment of the non-bonded interaction parameters of force fields against physical property data sets.

Copyright

Copyright (c) 2020, Simon Boothroyd