Items where Author is "Raghunathan, Shampa"
Number of items: 3. 2020Devereux, Mike and Pezzella, Marco and Raghunathan, Shampa and Meuwly, Markus. (2020) Polarizable Multipolar Molecular Dynamics Using Distributed Point Charges. Journal of Chemical Theory and Computation, 16 (12). pp. 7267-7280. 2018Raghunathan, Shampa and El Hage, Krystel and Desmond, Jasmine L. and Zhang, Lixian and Meuwly, Markus. (2018) The Role of Water in the Stability of Wild-type and Mutant Insulin Dimers. Journal of Physical Chemistry B, 122 (28). pp. 7038-7048. 2014Devereux, Mike and Raghunathan, Shampa and Fedorov, Dmitri G. and Meuwly, Markus. (2014) A Novel, Computationally Efficient Multipolar Model Employing Distributed Charges for Molecular Dynamics Simulations. Journal of Chemical Theory and Computation, 10 (10). pp. 4229-4241. |
