Organizers: Pratyush Tiwary, University of Maryland, College ParkCecilia Clementi, Free University BerlinTeresa Head-Gordon, University of...
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Short paragraph about the motivation, goal and description of the user groups
MOPAC User Groups
Presenter | Time | Topics |
---|---|---|
Jonathan Moussa | 11:00 am | Open-source MOPAC Overview |
Jame Stewart | 11:20 am | MOPAC Model Development & PM6-ORG |
SCM Representative | 11:40 am | MOPAC in SCM |
Jan Rezac | 12:00 pm | Classical Corrections and Reference Data for MOPAC |
Gerd Rocha | 12:20 pm | GPU Acceleration in MOPAC |
Will Polik | 12:40 pm | MOPAC in WebMO |
Groups | 1:00 pm | Discussion #1 & Break |
Rebecca Gieseking | 1:20 pm | INDO/S in MOPAC |
Brent Westbrook | 1:40 pm | Astrochemistry Application of MOPAC |
MOE Representative | 2:00 pm | MOPAC in MOE |
Nigel Richards | 2:20 pm | Enzyme Application of MOPAC |
Nigel Moriarty | 2:40 pm | MOPAC in Phenix |
Groups | 3:00 pm | Discussion #2 |