Matches in DBpedia 2016-04 for { <http://dbpedia.org/resource/MOPAC> ?p ?o }
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- MOPAC abstract "MOPAC is a popular computer program used in computational chemistry. It is designed to implement semi-empirical quantum chemistry algorithms, and it runs on Windows, Mac, and Linux.MOPAC2012 is the current version. MOPAC2009 is able to perform calculations on small molecules and enzymes using PM6, PM3, AM1, MNDO, and RM1. The Sparkle model (for lanthanide chemistry) is also available. This program is available in Windows, Linux, and Macintosh. Academic users can use this program for free, whereas government and commercial users must purchase the software.MOPAC was largely written by Michael Dewar's research group at the University of Texas at Austin. Its name is derived from Molecular Orbital PACkage, and it is also a pun on the Mopac Expressway that runs around Austin.MOPAC2007 included the new Sparkle/AM1, Sparkle/PM3, RM1 and PM6 models, with an increased emphasis on solid state capabilities. However, it does not have yet MINDO/3, PM5, analytical derivatives, the Tomasi solvation model and intersystem crossing. MOPAC2007 was followed by the release of MOPAC2009 in 2008 which presents many improved features The latest versions are no longer public domain software as were the earlier versions such as MOPAC6 and MOPAC7. However, there are recent efforts to keep MOPAC7 working as open source software. An open source version of MOPAC7 for Linux is also available. The author of MOPAC, James Stewart, released in 2006 a public domain version of MOPAC7 entirely written in Fortran 90 called MOPAC7.1.".
- MOPAC wikiPageExternalLink index.html.
- MOPAC wikiPageExternalLink mopac.
- MOPAC wikiPageExternalLink Download_MOPAC_Executable_Step2.html.
- MOPAC wikiPageExternalLink index_en.html.
- MOPAC wikiPageExternalLink mopac.html.
- MOPAC wikiPageExternalLink Mopac2002manual.
- MOPAC wikiPageExternalLink index.shtml.
- MOPAC wikiPageExternalLink index.shtml.
- MOPAC wikiPageExternalLink index.shtml.
- MOPAC wikiPageExternalLink index.shtml.
- MOPAC wikiPageExternalLink index.shtml.
- MOPAC wikiPageExternalLink index.shtml.
- MOPAC wikiPageID "2233706".
- MOPAC wikiPageLength "4007".
- MOPAC wikiPageOutDegree "27".
- MOPAC wikiPageRevisionID "641346476".
- MOPAC wikiPageWikiLink AMPAC.
- MOPAC wikiPageWikiLink Category:Computational_chemistry_software.
- MOPAC wikiPageWikiLink Compiler.
- MOPAC wikiPageWikiLink Computational_Chemistry_List.
- MOPAC wikiPageWikiLink Computational_chemistry.
- MOPAC wikiPageWikiLink Computer_program.
- MOPAC wikiPageWikiLink Executable.
- MOPAC wikiPageWikiLink Fortran.
- MOPAC wikiPageWikiLink Linux.
- MOPAC wikiPageWikiLink List_of_quantum_chemistry_and_solid-state_physics_software.
- MOPAC wikiPageWikiLink MS-DOS.
- MOPAC wikiPageWikiLink Mac_OS.
- MOPAC wikiPageWikiLink Michael_J._S._Dewar.
- MOPAC wikiPageWikiLink Microsoft_Windows.
- MOPAC wikiPageWikiLink Public_domain_software.
- MOPAC wikiPageWikiLink Quantum_chemistry.
- MOPAC wikiPageWikiLink Semi-empirical_quantum_chemistry_method.
- MOPAC wikiPageWikiLink Source_code.
- MOPAC wikiPageWikiLink Sparkle_model.
- MOPAC wikiPageWikiLink Texas_State_Highway_Loop_1.
- MOPAC wikiPageWikiLink University_of_Texas_at_Austin.
- MOPAC wikiPageWikiLink Windows_95.
- MOPAC wikiPageWikiLink Windows_NT.
- MOPAC wikiPageWikiLinkText "MOPAC".
- MOPAC wikiPageWikiLinkText "OpenMopac".
- MOPAC wikiPageUsesTemplate Template:Other_uses.
- MOPAC wikiPageUsesTemplate Template:Reflist.
- MOPAC subject Category:Computational_chemistry_software.
- MOPAC hypernym Program.
- MOPAC type Work.
- MOPAC comment "MOPAC is a popular computer program used in computational chemistry. It is designed to implement semi-empirical quantum chemistry algorithms, and it runs on Windows, Mac, and Linux.MOPAC2012 is the current version. MOPAC2009 is able to perform calculations on small molecules and enzymes using PM6, PM3, AM1, MNDO, and RM1. The Sparkle model (for lanthanide chemistry) is also available. This program is available in Windows, Linux, and Macintosh.".
- MOPAC label "MOPAC".
- MOPAC sameAs Q3841464.
- MOPAC sameAs MOPAC.
- MOPAC sameAs MOPAC.
- MOPAC sameAs m.06x_tm.
- MOPAC sameAs Q3841464.
- MOPAC wasDerivedFrom MOPAC?oldid=641346476.
- MOPAC isPrimaryTopicOf MOPAC.