MOPAC-COSMO

Features MOPAC-COSMO

Authors of the code: James J.P.
Stewart (MOPAC 7), Serge Pachkovsky, Aoyama Iwao (COSMO patch)Homepage: The official website of MOPAC® is maintained by Stewart Computational Chemistry.http://openmopac.net/The COSMO modification of the original code is described here.https://github.com/brhr-iwao/MOPAC7SPSource: The official sources (up to MOPAC 7.1) are available in the official website.
http://openmopac.net/More recent versions (MOPAC2007, MOPAC2009, MOPAC2012, MOPAC2016) are not open-source.
There is plenty of other sites which distribute some flavour of MOPAC - CCL archives, funet archives, SourceForge, GitHub etc.http://www.ccl.net/cca/software/MS-DOS/mopac_for_dos/index.shtml http://www.nic.funet.fi/pub/sci/chem/qcpe/mopac6.0/ https://sourceforge.net/projects/mopac7/https://github.com/metapfhor/MOPACThe patched source used for this distribution was taken fromhttps://github.com/brhr-iwao/MOPAC7SPReference: Stewart, James J.P., Journal of computer-aided molecular design 4(1) (1990) 1-103.Description & Use:MOPAC is one of the most favourite and well-known semiempirical package which enables MNDO, MINDO/3, AM1 and PM3 calculations.
This particular version enables also the COSMO calculations.MOPAC-COSMO app replaces the obsolete MOBOSOL program.
Quick start: check the included manualsProgram status:The current package contains MOPAC-COSMO binaries based on MOPAC 7 compiled for the particular Android hardware platforms and adapted for running in generic, stock devices.
The app requires permission to access the file-storage.
It works completely offline and does not contain ads.License:The distribution is published for free at Mobile Chemistry Portal and Google Play Store with kind permission of James Stewart.
We are also grateful to Aoyama Iwao (GitHub, https://github.com/brhriwao/) for ready-to-compilation form of patched MOPAC 7 source code.For more details on licenses of used software, please check the included README file and the corresponding license files inside of the package.Contact:Compilation of the source code for Android/Windows as well as the Android/Windows app development was done by Alan Liška ([email protected]) and Veronika Růžičková ([email protected]), J.
Heyrovský Institute of Physical Chemistry of the CAS, v.v.i., Dolejškova 3/2155, 182 23 Praha 8, Czech Republic.Website: http://www.jh-inst.cas.cz/~liska/MobileChemistry.htm