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Incorporating Target Protein Structure Flexibility and Dynamics in Computational Drug Discovery Using Ensemble-Based Docking Analysis
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Bio-inspired algorithms applied to molecular docking simulations

G Heberlé1, W F de Azevedo

  • 1Faculdade de Biociências, Laboratório de Bioquímica Estrutural, Programa de Pós-Graduação em Biologia Celular e Molecular, Instituto Nacional de Ciência e Tecnologia em Tuberculose-Pontifícia Universidade Católica do Rio Grande do Sul, CEP 90619-900, Porto Alegre - RS, Brazil.

Current Medicinal Chemistry
|March 4, 2011
PubMed

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