Molecular Modeling and Simulation of Complex Molecules
- Conference: AIChE Annual Meeting
- Year: 2010
- Proceeding: 2010 Annual Meeting
- Group:
- Type: Oral
- Room: Canyon C
- Location: Hilton
- Time: Friday, November 12, 2010 - 8:30am-11:00am
Chair(s):
Santiso, E. E., Massachusetts Institute of Technology
Co-chair(s):
Ismail, A. E., Sandia National Laboratories
We invite papers presenting computational investigations of large-scale molecules (highly functionalized polymers, biomolecules, aromatics, etc.). Contributions at the quantum, atomistic, or coarse-grained length scales are all acceptable. Papers showing direct comparisons to experimental measurements or theoretical predictions are especially encouraged.
Papers:
Topics:
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