./wip/py-mdtraj, The analysis of molecular dynamics trajectories

[ CVSweb ] [ Homepage ] [ RSS ] [ Required by ] [ Add to tracker ]


Branch: CURRENT, Version: 1.8.0, Package name: py27-mdtraj-1.8.0, Maintainer: jihbed.research

MDTraj is a python library that allows users to manipulate molecular
dynamics(MD) trajectories and perform a variety of analyses, including
fast RMSD, solvent accessible surface area, hydrogen bonding, etc.
A highlight of MDTraj is the wide variety of molecular dynamics trajectory
file formats which are supported, including RCSB pdb, GROMACS xtc, tng,
and trr, CHARMM/NAMD dcd, AMBER binpos, AMBER NetCDF, AMBER mdcrd,
TINKER arc and MDTraj HDF5


Required to run:
[devel/py-setuptools] [math/py-numpy] [devel/py-cython] [lang/python27]

Required to build:
[pkgtools/cwrappers]

Master sites:

SHA1: d06b8e7f3b5fc9fdba62a11bda77eb62416ceae8
RMD160: 539fa565eabff3bfccbc21cc787ecbcf27c7566a
Filesize: 19372.988 KB

Version history: (Expand)