Theses most similar to Molecular simulation of biomaterials and biomolecules at the solid-liquid interface (Kottmann, Stephen Thomas; 2008) read it
- Advisors: Bernhardt L. Trout; Daniel I.C. Wang
- Department of Chemical Engineering
- Advisors: Bernhardt L. Trout; Daniel I.C. Wang
- Department of Chemical Engineering
Efficient numerical algorithms for surface formulations of mathematical models for biomolecule analysis and design
Bardhan, Jaydeep Porter, 1978- (2006)
- Advisors: Bruce Tidor; Jacob K. White
- Department of Electrical Engineering and Computer Science
First-principles molecular modeling of structure-property relationships and reactivity in the zeolite chabazite
Lo, Cynthia (2005)
- Advisor: Bernhardt L. Trout
- Department of Chemical Engineering
- Advisor: Nicola Marzari
- Department of Physics
Theoretical investigation of solar energy conversion and water oxidation catalysis
Wang, Lee-Ping (2011)
- Advisor: Troy Van Voorhis
- Department of Chemistry
Binding affinity of a small molecule to an amorphous polymer in a solvent
Chunsrivirot, Surasak (2011)
- Advisor: Bernhardt L. Trout
- Computational and Systems Biology Program
Optimization of electrostatic binding free energy : application to barnase and barstar
Lee, Lee-Peng, 1969- (1999)
- Advisors: Bruce Tidor; George B. Benedek
- Department of Physics
Mathematical modeling of lithium-ion intercalation particles and their electrochemical dynamics
Zeng, Yi (2015)
- Advisor: Martin Z. Bazant
- Department of Mathematics