1.Department of Chemistry, Yale University, P. O. Box 208107, New Haven, CT, 06520-8107, USA ;3.Theoretical Division, Los Alamos National Laboratory, Los Alamos, NM, 87545, USA ;
Abstract:
Photosynthesis Research - Quantum mechanics/molecular mechanics (QM/MM) hybrid methods are currently the most powerful computational tools for studies of structure/function relations and structural...