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

QC-Lab

This resource has a 2.9 Ranking

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

Usage Stats
Overall Period: Updated 06 Oct, 2008
Users: 1659
Jobs: 54439
Avg. exec. time: 8 secs
Reviews & Citations
Google/IEEE
Avg. Review: 1.5 out of 5 stars
Citations: 0

1659 users, detailed statistics

9 reviews (Review this)

0 citations

0 questions (Ask a question)

Launch Tool

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This tool is closed source.

Available Versions

Version 2.1 - published on 17 Sep, 2008
Contributor(s) Baudilio Tejerina
Northwestern University, Evanston
At a glance Quantum Chemsitry Lab
Screenshots
  • Screenshot #1
Description

The aim of QC-Lab is to facilitate the elaboration and study of molecular theoretical models in Gas Phase and Solution. QC-Lab puts together the instructions in GAMESS language and automatically submits the job for execution. Once the task has been accomplished, QC-Lab retrieves the data where a variety of molecular properties may be read from: Optimum molecular structure, atomic charge distribution, dipole moment, thermodynamic state functions, etc.

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GAMESS (General Atomic and Molecular Electronic System)
GAMESS is maintained by the members of the Gordon research group at Iowa State University.

Cite this work

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

  • Tejerina, Baudilio (2006), "QC-Lab," doi: 10254/nanohub-r1035.4.

    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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Reviews

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  1. 1.0 out of 5 stars 

    Posted on 24 January, 2008 by Anonymous

    0   0   Login to vote Worst program ever. I have never used something so frustrating and poorly organized. The arrows stick all over the screen making it basically useless. I can't believe I'm paying 50k a year to be forced to use this stupid website. Also, it crashes for no damn reason even after entering the correct coordinates that had JUST WORKED on the program. This is garbage.

    reply | report abuse
  2. 1.0 out of 5 stars 

    Posted on 24 January, 2008 by Anonymous

  3. 1.0 out of 5 stars 

    Posted on 23 January, 2008 by Anonymous

  4. 1.0 out of 5 stars 

    Posted on 21 January, 2008 by Anonymous

    0   0   Login to vote Utter and complete garbage.

    reply | report abuse
  5. 1.0 out of 5 stars 

    Posted on 17 January, 2007 by Anonymous

  6. 1.0 out of 5 stars 

    Posted on 17 January, 2007 by Vanessa Valenzuela

  7. 1.0 out of 5 stars 

    Posted on 21 October, 2006 by Anonymous

    0   0   Login to vote horrible. very poor directions, very slow, screen does not refresh itself so it gets covererd in arrows and you can not see the drop menues. very confusing.

    reply | report abuse
  8. 1.0 out of 5 stars 

    Posted on 26 February, 2006 by Matt Gallovic

    0   0   Login to vote freezes too many times for me to count

    reply | report abuse
  9. 4.0 out of 5 stars 

    Posted on 15 February, 2006 by Fred Arnold

See also

The following are resources that may cover similar or related topics.

  • 5.1 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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