Please do not reply directly to this email. All additional comments should be made in the comments box of this bug. Summary: Review Request: ghemical - Molecular mechanics and quantum mechanics frontend for GNOME https://bugzilla.redhat.com/show_bug.cgi?id=542767 Summary: Review Request: ghemical - Molecular mechanics and quantum mechanics frontend for GNOME Product: Fedora Version: rawhide Platform: All OS/Version: Linux Status: NEW Severity: medium Priority: medium Component: Package Review AssignedTo: nobody@xxxxxxxxxxxxxxxxx ReportedBy: carl@xxxxxxxxxxxxxxx QAContact: extras-qa@xxxxxxxxxxxxxxxxx CC: notting@xxxxxxxxxx, fedora-package-review@xxxxxxxxxx Estimated Hours: 0.0 Classification: Fedora Spec URL: http://www.five-ten-sg.com/ghemical.spec SRPM URL: http://www.five-ten-sg.com/ghemical-2.99.2-4.fc12.src.rpm Description: Ghemical is a computational chemistry application. 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. This is part of my project to get ghemical and its dependencies into Fedora. ghemical buildrequires: f2c libSC-devel mopac7-devel oglappth-devel libghemical-data libghemical buildrequires: f2c libSC-devel mopac7-devel mopac7 buildrequires: f2c mpqc provides libSC7, libSC-devel oglappth provides oglappth-devel f2c provides f2c -- Configure bugmail: https://bugzilla.redhat.com/userprefs.cgi?tab=email ------- You are receiving this mail because: ------- You are on the CC list for the bug. _______________________________________________ Fedora-package-review mailing list Fedora-package-review@xxxxxxxxxx http://www.redhat.com/mailman/listinfo/fedora-package-review