One-dimensional molecular representations and similarity calculations: Methodology and validation

Journal of Medicinal Chemistry

Volumn 44, Issue 23, 2001, Pages 3795-3809

  Dixon, S L ^a   Merz, Jr ^b  

^a Accelrys   (United States)

^b PENNSYLVANIA STATE UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

1,2,4 TRIAZOLINONE BIPHENYLSULFONAMIDE; 4 AMINOBUTYRIC ACID A RECEPTOR; ADENOSINE; ADENOSINE A2A RECEPTOR; ALPHA ADRENERGIC RECEPTOR; ANGIOTENSIN 1 RECEPTOR; BETA ADRENERGIC RECEPTOR; BETA CARBOLINE DERIVATIVE; BIS(ACRIDINE 4 CARBOXAMIDE); CORTICOSTEROID; CORTODOXONE; DIPEPTIDYL CARBOXYPEPTIDASE INHIBITOR; DNA TOPOISOMERASE INHIBITOR; DOPAMINE 2 RECEPTOR; DOPAMINE 4 RECEPTOR; ENDOTHELIN A RECEPTOR; ENDOTHELIN A RECEPTOR ANTAGONIST; HISTAMINE H2 RECEPTOR ANTAGONIST; LIGAND; MELATONIN RECEPTOR; N NAPHTHYLETHYLAMIDE; NEUROLEPTIC AGENT; RECEPTOR SUBTYPE; SEROTONIN 1A ANTAGONIST; SEROTONIN 1A RECEPTOR; SEROTONIN 2 RECEPTOR; SEROTONIN RECEPTOR; SULFONAMIDE; TRANSCORTIN; UNCLASSIFIED DRUG; UNINDEXED DRUG;

ALGORITHM; AMINO ACID SEQUENCE; ARTICLE; BINDING AFFINITY; CHEMICAL STRUCTURE; DRUG RESEARCH; DRUG STRUCTURE; MOLECULAR MODEL; PHARMACOPHORE; QUANTITATIVE STRUCTURE ACTIVITY RELATION; SEQUENCE HOMOLOGY;

DRUG DESIGN; MODELS, MOLECULAR; MOLECULAR CONFORMATION; MOLECULAR STRUCTURE; STEROIDS; STRUCTURE-ACTIVITY RELATIONSHIP;

EID: 0035829402     PISSN: 00222623     EISSN: None     Source Type: Journal    
DOI: 10.1021/jm010137f     Document Type: Article

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