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Organic and Biomolecular Chemistry

Volumn 11, Issue 38, 2013, Pages 6515-6519

Error estimates for (semi-)empirical dispersion terms and large biomacromolecules

(1) Korth, Martin a

a UNIVERSITY OF ULM (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

DENSITY FUNCTIONAL TIGHT BINDING METHOD; DISPERSION CONTRIBUTION; DISPERSION CORRECTION; ELECTRONIC STRUCTURE THEORY; FIRST-PRINCIPLES MODEL; FORCE-FIELD APPROACHES; PROTEIN-LIGAND INTERACTIONS; VAN DER WAALS INTERACTION;

BIOLOGICAL MATERIALS; ELECTRONIC STRUCTURE; ERROR STATISTICS; ESTIMATION; VAN DER WAALS FORCES;

DISPERSIONS;

ARTICLE; CHEMISTRY; MACROMOLECULE; QUANTUM THEORY;

MACROMOLECULAR SUBSTANCES; QUANTUM THEORY;

EID: 84884171838 PISSN: 14770520 EISSN: None Source Type: Journal
DOI: 10.1039/c3ob41309h Document Type: Article

Times cited : (9)

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