QuickFF¶
QuickFF is a Python package developed at the Center for Molecular Modeling (CMM) to quickly derive accurate force fields from ab initio calculations.
homepage: http://molmod.github.io/QuickFF/
| version | versionsuffix | toolchain |
|---|---|---|
2.1.4 |
-Python-2.7.12 |
intel/2016b |
2.2.0 |
-Python-2.7.14 |
intel/2017b |
2.2.4 |
-Python-3.7.2 |
intel/2019a |
2.2.4 |
-Python-3.8.2 |
intel/2020a |
2.2.7 |
foss/2023a |
|
2.2.7 |
-Python-3.8.2 |
intel/2020a |
(quick links: (all) - 0 - a - b - c - d - e - f - g - h - i - j - k - l - m - n - o - p - q - r - s - t - u - v - w - x - y - z)