2014 AIChE Annual Meeting

Session: Plenary Session: Computational Molecular Science and Engineering Forum

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

Chair

Kristen Fichthorn, The Pennsylvania State University

Co-Chair

David Sholl, Georgia Institute of Technology

Presentations

12:30 PM

(520a) Understanding the Self-Assembly of Skin Lipids
Clare McCabe

01:10 PM

(520b) Entropic and Active Matter: Insights from Simulation
Sharon C. Glotzer

01:30 PM

(520c) How the Walls Come Crumbling Down: Elucidating Mechanisms of Cellulose-Active Enzymes Using Molecular Simulation
Gregg T. Beckham

02:10 PM

(520d) Isolated Catalyst Sites on Amorphous Supports: A Systematic Ab Initio Route to Structure-Property Relationships
Baron Peters, Bryan R Goldsmith, Evan Sanderson, Daniel Bean

02:30 PM

(520e) Understanding and Applying Multistate Reweighting in a Broad Molecular Simulation Context
Michael R. Shirts, Himanshu Paliwal, John Chodera