Name : ghemical
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Version : 1.00
| Vendor : MandrakeSoft
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Release : 2mdk
| Date : 2003-02-02 22:30:39
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Group : Sciences/Chemistry
| Source RPM : ghemical-1.00-2mdk.src.rpm
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Size : 5.96 MB
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Packager : Lenny Cartier < lenny_mandrakesoft_com>
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Summary : Molecular mechanics and quantum mechanics frontend for GNOME.
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Description :
Ghemical is a computational chemistry software package released under the GNU GPL. Ghemical is written in C++. It has a graphical user interface (in fact, a couple of them), and it supports both quantum-mechanics (semi-empirical and ab initio) models and molecular mechanics models (there is an experimental Tripos 5.2-like force field for organic molecules). Also a tool for reduced protein models is included. Geometry optimization, molecular dynamics and a large set of visualization tools are currently available.
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RPM found in directory: /vol/rzm6/linux-mandriva/official/9.1/contrib/i586 |