Modeling protein-ligand complexes.
Curr Opin Struct Biol
; 6(2): 236-41, 1996 Apr.
Article
em En
| MEDLINE
| ID: mdl-8728658
ABSTRACT
Increasing the rate at which new biologically active compounds are found is a major goal in pharmaceutical chemistry. Recently, several computational methods have been proposed with this intent. For some time, algorithms have been used to direct ligand evolution on the basis of complementarity to the three-dimensional structure of a selected protein. Current research focuses on enhancements to methods for searching chemical databases, proposing sensible modifications to known active compounds, and construction of novel ligands from theoretical principles.
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Coleções:
01-internacional
Base de dados:
MEDLINE
Assunto principal:
Simulação por Computador
/
Desenho de Fármacos
/
Proteínas
/
Modelos Moleculares
/
Ligantes
Idioma:
En
Revista:
Curr Opin Struct Biol
Assunto da revista:
BIOLOGIA MOLECULAR
Ano de publicação:
1996
Tipo de documento:
Article
País de afiliação:
Estados Unidos