ABSTRACT
As computational hardware continues to develop at a rapid pace, quantitative computations are playing an increasingly essential role in the study of biomolecular systems. One of the most important challenges that the field faces is to develop the next generation of computational models that strike the proper balance of computational efficiency and
TABLE OF CONTENTS
part |2 pages
Section I: QM and QM/MM Methods
part |2 pages
Section II: Atomistic Models
part |2 pages
Section III: Coarse-Grained Models