Recent Advances in Molecular Simulation Methods I
AIChE Annual Meeting
2015 AIChE Annual Meeting Proceedings
Computational Molecular Science and Engineering Forum
Salt Palace Convention Center
Tuesday, November 10, 2015 - 8:30am to 11:00am
Santiso, E., NC State University
Peters, B., University of California Santa Barbara
Ismail, A. E., RWTH Aachen University
Keith, J., University of Pittsburgh
Contributions describing recent advances in the application of molecular simulation methods to any area of application. Note: There will be a special sub-session on rare events. This sub-session will focus on novel approaches to study activated processes, for which traditional molecular simulation approaches are impractical due to a separation of time scales. Papers discussing new methods to find the mechanisms and rates of complex activated processes, as well as applications of such methods, are welcome.
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