A Multiscale Model for Virus Capsid Dynamics by Changjun Chen, Rishu Saxena, Guo-Wei Wei

“…In our approach, the differential geometry theory of surfaces and geometric measure theory are employed as a natural means to couple the macroscopic continuum domain of the fluid mechanical description of the aquatic environment from the microscopic discrete domain of the atomistic description of the biomolecule. …”
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Modeling and analysis of ensemble average solvation energy and solute–solvent interfacial fluctuations by Shao Yuanzhen, Chen Zhan, Zhao Shan

“…Drawing upon principles of statistical mechanics and geometric measure theory, we rigorously demonstrate that the proposed models effectively capture EASE during the solvation process. …”
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