Modeling zinc in biomolecules with the self consistent charge-density functional tight binding (SCC-DFTB) method: Applications to structural and energetic analysis [Review]

TitleModeling zinc in biomolecules with the self consistent charge-density functional tight binding (SCC-DFTB) method: Applications to structural and energetic analysis [Review]
Publication TypeJournal Article
Year of Publication2003
AuthorsElstner, M, Cui, Q, Munih, P, Kaxiras, E, Frauenheim, T, Karplus, M
JournalJournal of Computational Chemistry
Volume24
Pagination565-581
Date PublishedApr 15
Accession Number662NT-0003