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Event: QuantumBio to present at American Chemical Society Conference - San Diego

March 13, 2016

QuantumBio staff will attend the ACS-San Deigo conference and be available for discussion.

The following talks will be presented by QuantumBio staff:

Talk: COMP 120 - Addressing the elephant in the room: The impact of experimental protein structural quality on our ability to model protein function
Location: Room 25C - San Diego Convention Center
Date/Time: Mon, Mar 14 at 2:50pm - 3:10pm 
Authors: Oleg Borbulevych, Roger Martin, Lance M. Westerhoff
Abstract: conference link

Talk: COMP 205 - Synergistic use of QM/MM x-ray crystallography and time-averaged MD analysis: Protonation-state modeling
Location: Room 25C - San Diego Convention Center
Date/Time: Tue, Mar 15 at 4:25pm - 4:45pm 
Authors: Oleg Borbulevych, Camilo Velez Vega, Lance M. Westerhoff, Daniel Mckay, Jose Duca
Abstract: conference link

 

The following talks and posters will be presented by collaborators at Michigan State University. Please be sure to stop by:

Talk: MPPG 36: Thermodynamics of virus capsid assembly
Location: Room 5A - San Diego Convention Center
Date/Time: Mon, Mar 14 at 1:00pm - 1:30pm
Authors: Kenneth Merz
Abstract: conference link

Talk: COMP 672: Further development of the movable-type energy sampling method and its application in the biomolecular systems
Location: Room 26B - San Diego Convention Center
Date/Time: Thu, Mar 17 at 1:30pm - 1:50pm 
Authors: Zheng Zheng, David Cerutti, Nupur Bansal, Kenneth Merz
Abstract: conference link

Poster: COMP 281 - Scalable, fragment-based ensemble generator for docking studies, structure prediction, and condensed-phase simulations
Location: Hall E - San Diego Convention Center
Date/Time: Tue, Mar 15 at 6:00pm - 8:00pm 
Authors: David Cerutti, Zheng Zheng, Nupur Bansal, Kenneth Merz
Abstract: conference link

Poster: COMP 303 - New approach to calculate the complexation-induced 1H NMR chemical shift changes in proteins
Location: Hall E - San Diego Convention Center
Date/Time: Tue, Mar 15 at 6:00pm - 8:00pm 
Authors: Zhuoqin Yu, Pengfei Li, Kenneth Merz
Abstract: conference link

Poster: COMP 304 - MTRec-flex: A novel method for incorporating flexibility in the receptor’s binding pocket
Location: Hall E - San Diego Convention Center
Date/Time: Tue, Mar 15 at 6:00pm - 8:00pm 
Authors: Nupur Bansal, Zheng Zheng, Kenneth Merz
Abstract: conference link