A general cross-platform text-based molecule builder for LAMMPS
Project description
Moltemplate is a general cross-platform text-based molecule builder for LAMMPS and ESPResSo. Moltemplate was intended for building custom coarse-grained molecular models, but it can be used to prepare realistic all-atom simulations as well. It supports a variety of force fields for all-atom and coarse-grained modeling (including many-body forces and non-point-like particles). New force fields and examples are added continually by users.
Project details
Release history Release notifications | RSS feed
Download files
Download the file for your platform. If you're not sure which to choose, learn more about installing packages.
Source Distribution
moltemplate-2.10.12.tar.gz
(239.6 kB
view hashes)
Built Distribution
moltemplate-2.10.12-py3-none-any.whl
(699.3 kB
view hashes)
Close
Hashes for moltemplate-2.10.12-py3-none-any.whl
Algorithm | Hash digest | |
---|---|---|
SHA256 | ef11869fbfdadd0c800ac5b4ed1e566ee8c11a6af22a9e473c90abfb9098b628 |
|
MD5 | a726b32964d97487e5de76c050042954 |
|
BLAKE2b-256 | ba0ae1b79c4dcac380fec8b250a214683f1f2f5d1de6c4c3ad6869941501b7ed |