Difference between revisions of "Ghemical"

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(New version)
(Added Debian link)
 
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|Component programs=MOPAC7 (public domain),MPQC (GNU GPL)
 
|Component programs=MOPAC7 (public domain),MPQC (GNU GPL)
 
|Computer languages=C++
 
|Computer languages=C++
 +
|Accepts cryptocurrency donations=No
 
|Related projects=GAMGI,GROMACS,gdpc,chemtool,XDrawChem,Bioinformatics_Template_Library,Jmol,E-CELL_Simulation_Environment
 
|Related projects=GAMGI,GROMACS,gdpc,chemtool,XDrawChem,Bioinformatics_Template_Library,Jmol,E-CELL_Simulation_Environment
 
|Keywords=Gnome,science,chemistry,ghemical,molecular modelling
 
|Keywords=Gnome,science,chemistry,ghemical,molecular modelling
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|Version status=stable
 
|Version status=stable
 
|Version download=http://www.bioinformatics.org/ghemical/download/current/ghemical-3.0.0.tar.gz
 
|Version download=http://www.bioinformatics.org/ghemical/download/current/ghemical-3.0.0.tar.gz
|Last review by=Alejandroindependiente
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|Last review by=Bendikker
|Last review date=2017/03/17
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|Last review date=2018/02/14
|Submitted by=Database conversion
 
 
|Submitted date=2011-04-01
 
|Submitted date=2011-04-01
|Status=
 
 
|Is GNU=No
 
|Is GNU=No
 
|License verified date=2002-02-22
 
|License verified date=2002-02-22
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|Role=Maintainer
 
|Role=Maintainer
 
|Email=thassine@messi.uku.fi
 
|Email=thassine@messi.uku.fi
|Resource URL=
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}}
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{{Resource
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|Resource audience=Debian (Ref)
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|Resource URL=https://tracker.debian.org/pkg/ghemical
 
}}
 
}}
 
{{Resource
 
{{Resource

Latest revision as of 11:57, 14 February 2018

[edit]

Ghemical

http://www.bioinformatics.org/ghemical/ghemical/index.html
Molecular modelling application

Ghemical is a molecular modelling software package with a GUI (one for the GLUT library, and another for GNOME), and some nice 3D-visualization tools. It supports methods based on both molecular mechanics and quantum mechanics (using MOPAC7, and MPQC for QM). The geometry optimization (for MM and QM) and molecular dynamics (for MM) algorithms are included.

Related Projects





Licensing

License

Verified by

Verified on

Notes

Verified by

Janet Casey

Verified on

22 February 2002




Leaders and contributors

Contact(s)Role
Tommi Hassinen Maintainer


Resources and communication

AudienceResource typeURI
Bug TrackingVCS Repository Webviewhttp://bioinformatics.org/bugs/?group_id=41
DeveloperVCS Repository Webviewhttp://bioinformatics.org/cgi-bin/cvsweb.cgi/ghemical/
DeveloperE-mailmailto:ghemical-devel@bioinformatics.org
Debian (Ref)https://tracker.debian.org/pkg/ghemical


Software prerequisites

KindDescription
Required to useGNOME

This entry (in part or in whole) was last reviewed on 14 February 2018.



Entry






Property "Submitted by" (as page type) with input value "{{{Submitted by}}}" contains invalid characters or is incomplete and therefore can cause unexpected results during a query or annotation process.











"Debian (Ref)" is not in the list (General, Help, Bug Tracking, Support, Developer) of allowed values for the "Resource audience" property.
















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