505 Plenary Session: Computational Molecular Science and Engineering Forum

Description:
Session celebrating the winner of the CoMSEF Mid Career Award. Contributions from projects of broad interest to the CoMSEF community are encouraged.

Sponsor:
Computational Molecular Science and Engineering Forum

Chair:
Kristen Fichthorn
Email: fichthorn@psu.edu

Co-Chair:
David S. Sholl
Email: david.sholl@chbe.gatech.edu


Papers:

12:30 PM
(505a) Using Molecular Simulation to Understand Interfacial Phenomena
Jeffrey R. Errington

1:10 PM
(505b) Theory and Simulation Studies Relating Molecular Features to Morphology in Polymer Nanocomposites
Arthi Jayaraman

1:50 PM
(505c) Revealing Reactions in Cellulose Pyrolysis
Heather Mayes, Gregg T. Beckham and Linda J. Broadbelt

2:10 PM
(505d) The Search for High-Pressure Ice Phases in Nanoconfined Water Via Molecular Simulation
Cody K. Addington, Katherine A. Phillips and Keith E. Gubbins

2:30 PM
(505e) Some Surprises Arising From Atomistic Simulation of Protein Dynamics On the Millisecond Timescale: Protein Folding and Conformational Change of Kinases and GPCRs
Vijay Pande
See more of this Group/Topical: Computational Molecular Science and Engineering Forum
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