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ghemical - Molecular mechanics and quantum mechanics frontend for GNOME.
/Main/Mandrake/10.2/src/Sciences/Chemistry/
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.
Homepage: http://www.uku.fi/~thassine/ghemical/ Package version: 1.01 Architecture: src Distribution: Mandrake 10.2 Filename: ghemical-1.01-2mdk.src.rpm
Browse inside ghemical-1.01-2mdk.src.rpm:
pkg://ghemical-1.01-2mdk.src.rpm:2489719/ downloads1.12 KB 2008-05-07HEADER view 193 mirrors
276 B 2008-05-07ghemical-1.01-gcc34.patch.bz2 view
2.37 MB 2008-05-07ghemical-1.01.tar.bz2 view 2 mirrors
2.73 KB 2008-05-07ghemical-16x16.png view 4 mirrors
2.73 KB 2008-05-07ghemical-32x32.png view 4 mirrors
2.73 KB 2008-05-07ghemical-48x48.png view 4 mirrors
3.22 KB 2008-05-07ghemical.spec view
Download ghemical-1.01-2mdk.src.rpm:
2006-08-22 ftp://ftp.tu-chemnitz.de/.SAN0/pub/linux/mandrakelinux/devel/10.1/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://ftp.tu-chemnitz.de/.SAN0/pub/linux/mandrakelinux/devel/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://ftp.nsysu.edu.tw/Linux/Mandrake/devel/10.2/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://ftp.nsysu.edu.tw/Linux/Mandrake/devel/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://sunsite.mff.cuni.cz/MIRRORS/ftp.sunet.se/pub/Linux/distributions/mandrake/devel/10.1/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://sunsite.mff.cuni.cz/MIRRORS/ftp.sunet.se/pub/Linux/distributions/mandrake/devel/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://ftp.ps.pl/dsk0/Mandrivalinux/devel/10.1/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://ftp.ps.pl/dsk0/Mandrivalinux/devel/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://204.152.191.39/mandrake/Mandrakelinux/devel/10.1/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://204.152.191.39/mandrake/Mandrakelinux/devel/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://204.152.191.39/mandrake/Mandrakelinux/old/10.1/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://204.152.191.39/mandrake/Mandrakelinux/old/10.2/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://77.88.19.68/mandriva/devel/10.1/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://77.88.19.68/mandriva/devel/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://ftp.esat.net/mirrors/.4/carroll.cac.psu.edu/Mandrakelinux/devel/10.1/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://ftp.filearena.net/mnt5/mandriva/devel/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://ftp.li.kernel.org/pub/.2/Mandrakelinux/devel/10.1/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://ftp.li.kernel.org/pub/.2/Mandrakelinux/devel/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://128.118.2.96/pub/.mirrors/1/rsync.mandriva.com/ftp/MandrivaLinux/devel/10.1/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://128.118.2.96/pub/.mirrors/1/rsync.mandriva.com/ftp/MandrivaLinux/devel/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://128.118.2.96/pub/.mirrors/1/rsync.mandriva.com/ftp/MandrivaLinux/old/10.1/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://128.118.2.96/pub/.mirrors/1/rsync.mandriva.com/ftp/MandrivaLinux/old/10.2/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://ftp.math.utah.edu/pub/mirrors/sunsite.uio.no/linux/mdl/devel/10.2/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://ftp.math.utah.edu/pub/mirrors/sunsite.uio.no/linux/mdl/devel/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://ftp.sh.cvut.cz/storage/1/mandriva/devel/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://ftp.sh.cvut.cz/storage/1/mandriva/old/10.1/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2006-08-22 ftp://ftp.sh.cvut.cz/storage/1/mandriva/old/10.2/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2005-09-11 ftp://ftp.tu-chemnitz.de/.SAN0/pub/linux/mandrakelinux/official/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2005-09-11 ftp://ftp.free.fr/.mirrors7/ftp.mandriva.com/MandrivaLinux/official/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2005-09-11 ftp://ftp.nsysu.edu.tw/Linux/Mandrake/official/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2005-09-11 ftp://sunsite.mff.cuni.cz/MIRRORS/ftp.sunet.se/pub/Linux/distributions/mandrake/official/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2005-09-11 ftp://ftp.ps.pl/dsk0/Mandrivalinux/official/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2005-09-11 ftp://204.152.191.39/mandrake/Mandrakelinux/official/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2005-09-11 ftp://77.88.19.68/mandriva/official/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2005-09-11 ftp://147.52.159.12/mirrors/linux/MandrivaLinux/official/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2005-09-11 ftp://ftp.filearena.net/mnt5/mandriva/official/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2005-09-11 ftp://ftp.li.kernel.org/pub/.2/Mandrakelinux/official/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2005-09-11 ftp://128.118.2.96/pub/.mirrors/1/rsync.mandriva.com/ftp/MandrivaLinux/official/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2005-09-11 ftp://ftp.informatik.rwth-aachen.de/pub/comp/Linux/mandrake/official/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2005-09-11 ftp://ftp.uni-kl.de/pub/linux/mandriva/official/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2005-09-11 ftp://ftp.math.utah.edu/pub/mirrors/sunsite.uio.no/linux/mdl/official/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2005-09-11 ftp://ftp.univ-lille1.fr/pub/os/linux/distributions/mandrakelinux/official/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2005-09-11 ftp://ftp.sh.cvut.cz/storage/1/mandriva/official/2006.0/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2004-10-04 ftp://ftp.tu-chemnitz.de/.SAN0/pub/linux/mandrakelinux/official/10.1/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2004-10-04 ftp://sunsite.mff.cuni.cz/MIRRORS/ftp.sunet.se/pub/Linux/distributions/mandrake/official/10.1/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2004-10-04 ftp://ftp.ps.pl/dsk0/Mandrivalinux/official/10.1/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2004-10-04 ftp://204.152.191.39/mandrake/Mandrakelinux/official/10.1/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2004-10-04 ftp://77.88.19.68/mandriva/official/10.1/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2004-10-04 ftp://ftp.ens-cachan.fr/mirror/Mandrakelinux/official/10.1/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
2004-10-04 ftp://ftp.esat.net/mirrors/.4/carroll.cac.psu.edu/Mandrakelinux/official/10.1/SRPMS/contrib/ghemical-1.01-2mdk.src.rpm
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