Package: wnpp Severity: wishlist Owner: Patrick Winnertz <win...@debian.org>
* Package name : gamessq Version : 1.1 Upstream Author : Brett Bode <br...@scl.ameslab.gov> * URL : http://www.msg.chem.iastate.edu/GAMESS/GamessQ/ * License : GPLv3 Programming Lang: C Description : gamess scheduling frontend gamessQ provides a queueing functionality for GAMESS computations running on your local desktop/laptop. gamessQ is a gui application and provides drag and drop fucntionality for running jobs with gamess that would otherwise require the use of the command line. .. Key Features: * Automatic execution of GAMESS jobs. * Allows you to specify the number of processors to use for each job. * Advanced process management allowing the user to pause and resume jobs without loosing data. * Backend daemon keeps the queue active even when you close the interface or log out. * Batch job operations. Every job operation can be done to multiple jobs at a time, allowing you to more easily manage a large queue. * A command line interface allowing you to manage the entire queue without a GUI. * Interface provided in MacMolPlt to send GAMESS jobs to gamessQ and in gamessQ to open the output in MacMolPlt. -- To UNSUBSCRIBE, email to debian-devel-requ...@lists.debian.org with a subject of "unsubscribe". Trouble? Contact listmas...@lists.debian.org
