Malika D. Kumarasiri, Ph.D.
Affiliations: | 2009 | Pennsylvania State University, State College, PA, United States |
Area:
theoretical and computational methods for describing chemical reactions in condensed phases and at interfacesGoogle:
"Malika Kumarasiri"Parents
Sign in to add mentor| Sharon Hammes-Schiffer | grad student | 2009 | Penn State | |
| (Anharmonic effects of small clusters of molecules and ranking activity of protein mutants.) | ||||
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Publications
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| Kumarasiri M, Baker GA, Soudackov AV, et al. (2009) Computational approach for ranking mutant enzymes according to catalytic reaction rates. The Journal of Physical Chemistry. B. 113: 3579-83 |
| Chakravorty DK, Kumarasiri M, Soudackov AV, et al. (2008) Implementation of umbrella integration within the framework of the empirical valence bond approach. Journal of Chemical Theory and Computation. 4: 1974-1980 |
| Kumarasiri M, Swalina C, Hammes-Schiffer S. (2007) Anharmonic effects in ammonium nitrate and hydroxylammonium nitrate clusters. The Journal of Physical Chemistry. B. 111: 4653-8 |