SCOPUS 정보 검색 플랫폼

Chemical Communications

Volumn 51, Issue 10, 2015, Pages 1764-1774

Using dispersion-corrected density functional theory to understand supramolecular binding thermodynamics

(3) Antony, Jens a Sure, Rebecca a Grimme, Stefan a

a UNIVERSITY OF BONN (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO CALCULATION; ACCURACY; BINDING AFFINITY; COMPLEX FORMATION; CONFORMATION; DENSITY FUNCTIONAL THEORY; DISPERSION; DISPERSION CORRECTED DENSITY FUNCTIONAL THEORY; ENCAPSULATION; GEOMETRY; HYDROGEN BOND; MOLECULAR DYNAMICS; MOLECULAR INTERACTION; REVIEW; SOLVATION; SOLVENT EFFECT; SUPRAMOLECULAR CHEMISTRY; SURFACE CHARGE; THERMODYNAMICS; CHEMISTRY; QUANTUM THEORY;

COORDINATION COMPOUND; PROTEIN BINDING;

COORDINATION COMPLEXES; PROTEIN BINDING; QUANTUM THEORY; THERMODYNAMICS;

EID: 84921677485 PISSN: 13597345 EISSN: 1364548X Source Type: Journal
DOI: 10.1039/c4cc06722c Document Type: Review

Times cited : (129)

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