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Journal of Molecular Modeling

Volumn 17, Issue 4, 2011, Pages 913-920

Theoretical study on interactions of β-cyclodextrin with helicobacter pylori eradicating agent (TG44)

(5) Jin, Xin a Wang, Xueye a Ren, Cuihuan a Miao, Yuan a Yi, Ling a

a XIANGTAN UNIVERSITY (China)

Author keywords

Cyclodextrin; Density functional theory (DFT); Inclusion complex; PM3; TG44

Indexed keywords

4 METHYLBENZYL 4' [4 (GUANIDINOMETHYL)CYLOHEXYLCARBONYLOXY]BIPHENYL 4 CARBOXLYLIC ACID; ANTIBIOTIC AGENT; BETA CYCLODEXTRIN; HYDROXYL GROUP; UNCLASSIFIED DRUG;

ANTIBACTERIAL ACTIVITY; ARTICLE; DENSITY FUNCTIONAL THEORY; ENTHALPY; HELICOBACTER PYLORI; MOLECULAR MODEL; NONHUMAN; PRIORITY JOURNAL; PROTON NUCLEAR MAGNETIC RESONANCE; STRUCTURE ACTIVITY RELATION; THEORETICAL STUDY; THERMODYNAMICS;

ANTI-BACTERIAL AGENTS; BENZOATES; COMPUTER SIMULATION; CYCLODEXTRINS; GUANIDINES; HELICOBACTER PYLORI; MODELS, MOLECULAR; MOLECULAR STRUCTURE;

HELICOBACTER PYLORI;

EID: 79958108740 PISSN: 16102940 EISSN: 09485023 Source Type: Journal
DOI: 10.1007/s00894-010-0781-x Document Type: Article

Times cited : (3)

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