IsoStar: A library of information about nonbonded interactions

Journal of Computer-Aided Molecular Design

Volumn 11, Issue 6, 1997, Pages 525-537

  Bruno, Ian J ^a   Cole, Jason C ^a   Lommerse, Jos P M ^a   Rowland, R Scott ^a,b   Taylor, Robin ^a   Verdonk, Marcel L ^a  

^a CAMBRIDGE CRYSTALLOGRAPHIC DATA CENTRE   (United Kingdom)

^b BIOCRYST PHARMACEUTICALS INC   (United States)

Author keywords

Brookhaven Protein Databank; Cambridge Structural Database; Intermolecular perturbation theory; Nonbonded interactions

Indexed keywords

DATA VISUALIZATION; HYDROGEN BONDS; PERTURBATION TECHNIQUES;

AB INITIO; BOND ACCEPTORS; BROOKHAVEN PROTEIN DATABANK; CAMBRIDGE STRUCTURAL DATABASES; DATABANKS; H-BONDS; INTERMOLECULAR PERTURBATION THEORY; LONE PAIR; NONBONDED INTERACTION; PROTEIN-LIGAND DOCKING;

PROTEINS;

LIGAND; PEPTIDE; PROTEIN; WATER;

ARTICLE; AUDIOVISUAL EQUIPMENT; BIOCHEMISTRY; CHEMISTRY; COMPUTER SIMULATION; CRYSTALLOGRAPHY; DRUG DESIGN; FACTUAL DATABASE; HYDROGEN BOND;

BIOCHEMISTRY; COMPUTER SIMULATION; CRYSTALLOGRAPHY; DATABASES, FACTUAL; DRUG DESIGN; HYDROGEN BONDING; LIGANDS; MODELS, STRUCTURAL; PEPTIDES; PROTEINS; WATER;

EID: 0031261930     PISSN: 0920654X     EISSN: None     Source Type: Journal    
DOI: 10.1023/A:1007934413448     Document Type: Article

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