mgltools-sff 1.5.7~rc1~cvs.20130519-1 (i386 binary) in ubuntu saucy
This package is part of the mgltools set of Python libraries which
provide an infrastructure for the analysis of protein structures and
their docking of chemical compounds.
.
It implements an Amber force field with an interface to a molecular
dynamics engine. SFF stands for simple force field. It is a C
implementation of the amber force field made by Tom Macke and David Case.
.
This package exposes a wrapped version of the prm structure which holds the
Amber parameters needed for an Amber calculation. It also exposes the mme
and md functions to perform molecular mechanics and dynamics respectively.
Details
- Package version:
- 1.5.7~rc1~cvs.20130519-1
- Status:
- Obsolete
- Component:
- multiverse
- Priority:
- Optional
Downloadable files
i386 build of mgltools-sff 1.5.7~rc1~cvs.20130519-1 in ubuntu saucy PROPOSED produced
these files:
Package relationships
- Depends on:
- Enhances: