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A script to turn molecular coordinates files into SCAD files

Project description

mol2scad

gpl3.0 Language grade: Python CodeFactor Code style: black PyPI

mol2scad is a script to turn molecular coordinates into SCAD files. Takes molfile / sdf coordinates as input, outputs a scad file for OpenSCAD.

Usage

python mol2scad.py -i <input molfile> -o <output scadfile>

or if installed via pip install mol2scad:

mol2scad -i <input molfile> -o <output scadfile>

A useful tool to obtain mol files is available via NIST.

Authors

Implementation builds on on makebucky.scad at http://www.thingiverse.com/thing:12675 by Paul Moews.

This script is developed as academic software by Dr. Andrew J. Bonham at the Metropolitan State University of Denver.

Project details


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Files for mol2scad, version 1.1.0
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