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NCN Nano-Devices for Medicine and Biology: Simulation Tools for Research

Molecular Structure Tracer

This resource has a 6.3 Ranking

Ranking is calculated from a formula comprised of user reviews and usage statistics. Learn more ›

Usage Stats
Overall Period: Updated 04 Dec, 2008
Users: 63
Jobs: 536
Avg. exec. time: 7 secs
Reviews & Citations
Google/IEEE
Avg. Review: 0.0 out of 5 stars
Citations: 0

63 users, detailed statistics

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This tool is closed source.

Available Versions

Version 1.3 - published on 05 May, 2008
Contributor(s) Baudilio Tejerina
Northwestern University, Evanston
At a glance High-quality display of molecular structures
Description

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.

Powered by

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

If you reference this work in a publication, please cite as follows:

  • Tejerina, Baudilio (2008), "Molecular Structure Tracer," doi: 10254/nanohub-r3983.4.

    BibTex | EndNote

In addition, we would appreciate it if you would add the following acknowledgment to your publication:

  • Simulation services for results presented here were provided by the Network for Computational Nanotechnology (NCN) at nanoHUB.org
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See also

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  • 5.0 Ranking Series Part of: NCN Nano-Devices for Medicine and Biology: Simulation Tools for Research

    NCN Nano-Devices for Medicine and Biology: Simulation Tools for Research

    Type Series
    Date 19 Jun, 2008
    Avg. Rating 0.0 out of 5 stars  (0)
    Rate this

    Many simulation tools are available on the nanoHUB. The tools have been well-tested and here include supporting materials so that they can be effectively used for research. The research tools include a first time users guide and supporting publications and theses.

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