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Published in 2023 at "International Journal of Molecular Sciences"
DOI: 10.3390/ijms24054700
Abstract: The generalized Born (GB) model is an extension of the continuum dielectric theory of Born solvation energy and is a powerful method for accelerating the molecular dynamic (MD) simulations of charged biological molecules in water.…
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Keywords:
energy;
generalized born;
born model;
model ... See more keywords