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Group Meeting Schedule
Event Archive
Group meetings are every Wednesday 12:00 PM - 1:30 PM unless otherwise noted
Lunch will accompany meetings.
Title: Towards more rapid free energy calculations for structure-based drug design
Date: 11/18/2009Time: 12:00 PM Speaker: Jennifer Knight
Agenda
| 12:00 - 12:20 PM: | Discussion of timely group topics, software updates, computer status, etc. (Brooks) |
| 12:20 - 1:10 PM: | Group meeting presentation (Designated speaker or visitor) |
| 1:10 - 1:30 PM: | Questions and discussion of presentation |
Title: CHARMM Forcefield-Independent Charge Incrementation
Date: 11/11/2009Time: 12:00 PM Speaker: Joseph Yesselman
Agenda
| 12:00 - 12:20 PM: | Discussion of timely group topics, software updates, computer status, etc. (Brooks) |
| 12:20 - 1:10 PM: | Group meeting presentation (Designated speaker or visitor) |
| 1:10 - 1:30 PM: | Questions and discussion of presentation |
Title: Conformational Studies of an Amyloid Peptide
Date: 11/04/2009Time: 12:00 PM Speaker: Alana Canfield
Agenda
| 12:00 - 12:20 PM: | Discussion of timely group topics, software updates, computer status, etc. (Brooks) |
| 12:20 - 1:10 PM: | Group meeting presentation (Designated speaker or visitor) |
| 1:10 - 1:30 PM: | Questions and discussion of presentation |
Title: Selectivity in Simple Ion-ligating Models Employing a Polarizable Force Field
Date: 10/28/2009Time: 12:00 PM Speaker: David Bostick
Agenda
| 12:00 - 12:20 PM: | Discussion of timely group topics, software updates, computer status, etc. (Brooks) |
| 12:20 - 1:10 PM: | Group meeting presentation (Designated speaker or visitor) |
| 1:10 - 1:30 PM: | Questions and discussion of presentation |
Abstract
Past research in the thermodynamic and structural analysis of simplified cation binding site models is reviewed. New insights derived from incorporating electronic degrees of freedom in the molecular models are presented. 
Title: Protein Dynamics from Femtoseconds to Microseconds
Date: 09/16/2009Time: 12:00 PM Speaker: Lennart Nilsson
Agenda
| 12:00 - 12:20 PM: | Discussion of timely group topics, software updates, computer status, etc. (Brooks) |
| 12:20 - 1:10 PM: | Group meeting presentation (Designated speaker or visitor) |
| 1:10 - 1:30 PM: | Questions and discussion of presentation |
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