efpmd Subpackage of libefp
A molecular simulation program based on LIBEFP
EFPMD is a molecular simulation program based on LIBEFP. It supports single point energy and gradient calculations, semi-numerical Hessian and normal mode analysis, geometry optimization, molecular dynamics simulations in microcanonical (NVE), canonical (NVT), and isobaric-isothermal (NPT) ensembles.
Releases Overview
| Release | Stable | Testing |
|---|---|---|
| Fedora Rawhide | 1.5.0-11.fc35 | - |
| Fedora 35 | 1.5.0-11.fc35 | - |
| Fedora 34 | 1.5.0-10.fc34 | - |
Package Info
Related Packages
- Upstream: https://libefp.github.io/
- License(s): BSD
- Maintainer: jussilehtola
Related Packages
You can contact the maintainers of this package via email at
libefp dash maintainers at fedoraproject dot org.
Sources on Pagure