mirror of
https://git.FreeBSD.org/ports.git
synced 2024-12-30 05:40:06 +00:00
870ff4f84f
An Open Source program library for molecular simulation applications PR: 42332 Submitted by: Glenn Johnson <glennpj@charter.net>
12 lines
590 B
Plaintext
12 lines
590 B
Plaintext
This is a port of MMTK (Molecular Modeling ToolKit). In addition to
|
|
providing ready-to-use implementations of standard algorithms, MMTK
|
|
serves as a code basis that can be easily extended and modified to deal
|
|
with standard and non-standard problems in molecular simulations.
|
|
|
|
MMTK consists of nothing more than a collection of Python modules, most
|
|
of which written in Python itself, with only a small time-critical part
|
|
(e.g. energy evaluation) written in C. MMTK applications are Python
|
|
programs that make use of these modules.
|
|
|
|
WWW: http://starship.python.net/crew/hinsen/MMTK/index.html
|