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Volumetric data module

Project description

Grid contains objects and functions pertaining to 3D volumetric (grid) data. It was specifically written for 3D-RISM distribution data but is by no means limited to such data. Grid requires numpy.

Typical usage often looks like this:

#!/usr/bin/env python

import grid

mygrid = grid.dx2Grid("mydxfilename")

Some files can be converted now using gridconvert.py:

gridconvert.py mydxfile.dx grd

Will yield an Accelrys DS .grd file

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Files for grid, version 0.3.0
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