Browsing College of Arts and Sciences (UMKC) by Title "Ab initio computational applications to complex biomolecular systems"
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Ab initio computational applications to complex biomolecular systems
(University of Missouri--Kansas City, 2012-01-17)A series of biomaterial related systems ― including water and DNA molecules ― have been studied using ab initio (first-principles) methods. By investigating the properties of water as the preliminary step, the hydrogen ...