A strategic solution to optimize molecular docking simulations using Fully-Flexible Receptor models.
Christian Vahl QuevedoRenata De ParisDuncan D. RuizOsmar Norberto de SouzaPublished in: Expert Syst. Appl. (2014)
Keyphrases
- decision making
- case study
- statistical models
- linear programming
- numerical algorithms
- experimental data
- prior knowledge
- complex systems
- probabilistic model
- drug discovery
- mathematical models
- computational models
- probability distribution
- genetic algorithm
- evolutionary algorithm
- artificial neural networks
- optimal solution
- three dimensional
- information systems
- social networks