GridDataFormats

Oliver Beckstein edited this page Sep 26, 2015 · 2 revisions

Description

The GridDataFormats package provides classes to unify reading and writing of n-dimensional datasets. One can read grid data from files, make them available as a Grid object, and allows one to write out the data again.

The package provides the module gridData, which is loaded with

import gridData

gridData is used in MDAnalysis in the MDAnalysis.analysis.density module.

Availability

The GridDataFormats package is available from http://pypi.python.org/pypi/GridDataFormats and can simply be installed with

easy_install GridDataFormats

or

pip install GridDataFormats

The package can make use of SciPy, so this should be installed beforehand.

The source code and latest development are available from https://github.com/orbeckst/GridDataFormats

Project Information

About
GNU GPL v2 code license
Labels: python, molecular dynamics, analysis, DCD, CHARMM, LAMMPS, NAMD, Gromacs, computer simulation, atoms, coordinates, trajectory, XTC, Library, object-oriented
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