Molecular Structure Tracer

By Baudilio Tejerina

Northwestern University

High-quality display of molecular structures

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This tool version is unpublished and cannot be run. If you would like to have this version staged, you can put a request through HUB Support.

Archive Version 1.0
Published on 05 Feb 2008, unpublished on 07 Feb 2008
Latest version: 1.5.2. All versions

doi:10.4231/D3KW57H6S cite this

This tool is closed source.

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Abstract

This tool allows the graphical representations of discrete objects (Molecules) whose geometry is given by the 3D-Cartesian coordinates of their parts (Atoms). The connection between atoms (chemical bonds) are empirically inferred from the standard (Cambridge Crystallographic Structure Database) atomic radii.

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gfortran - GNU fortran. http://gcc.gnu.org/fortran/
Rappture- Rapid application Infrastructure. https://developer.nanohub.org/projects/rappture/
POVRAY - Persistence of Vision Raytracer. http://www.povray.org/
OpenSSL - Source Sockets Layer. http://www.openssl.org/

Cite this work

Researchers should cite this work as follows:

  • Baudilio Tejerina (2014), "Molecular Structure Tracer," http://nanohub.org/resources/MolST. (DOI: 10.4231/D3KW57H6S).

    BibTex | EndNote

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