Classical Force Field Simulations of Biological Processes and Quantum Chemical Computations of Homogeneous Catalysts
<p>Computational chemistry methods and tools have enabled studies of biological processes and chemical reactions to get insights from detailed atomic structures and reaction mechanisms. In this thesis, two biological problems are attacked by the classical force fields simulations and two homog...
Internet
https://thesis.library.caltech.edu/9849/7/FanLiu2016thesis.pdfLiu, Fan (2016) Classical Force Field Simulations of Biological Processes and Quantum Chemical Computations of Homogeneous Catalysts. Dissertation (Ph.D.), California Institute of Technology. doi:10.7907/Z94M92J2. https://resolver.caltech.edu/CaltechTHESIS:06062016-153802648 <https://resolver.caltech.edu/CaltechTHESIS:06062016-153802648>