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Journal of Computer-Aided Molecular Design

Volumn 20, Issue 4, 2006, Pages 209-225

Hierarchical clustering analysis of flexible GBR 12909 dialkyl piperazine and piperidine analogs

(2) Gilbert, Kathleen M a Venanzi, Carol A a

a NEW JERSEY INSTITUTE OF TECHNOLOGY (United States)

Author keywords

Clustering; Cocaine; Conformational analysis; Dopamine reuptake inhibitor; GBR 12909; Hierarchical; Molecular mechanics; Pharmacophore modeling; XCluster

Indexed keywords

AMINES; CONFORMATIONS; MOLECULAR MECHANICS; NEUROPHYSIOLOGY; PHARMACODYNAMICS;

CLUSTERINGS; COCAINE; CONFORMATIONAL ANALYSIS; DOPAMINE; DOPAMINE REUPTAKE INHIBITOR; GBR 12909; HIERARCHICAL; PHARMACOPHORE MODELS; PHARMACOPHORES; XCLUSTER;

MOLECULES;

DOPAMINE UPTAKE INHIBITOR; PIPERAZINE DERIVATIVE; PIPERIDINE DERIVATIVE; UNCLASSIFIED DRUG; VANOXERINE; VANOXERINE DIALKYLPIPERAZINE;

ARTICLE; CLUSTER ANALYSIS; COMPUTER ANALYSIS; CONTROLLED STUDY; DRUG CONFORMATION; DRUG STRUCTURE; MATHEMATICAL COMPUTING; MOLECULAR MODEL; PHARMACOPHORE; PRIORITY JOURNAL; QUANTITATIVE STRUCTURE ACTIVITY RELATION;

EID: 33748263780 PISSN: 0920654X EISSN: 15734951 Source Type: Journal
DOI: 10.1007/s10822-006-9046-2 Document Type: Article

Times cited : (8)

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