Docking by Monte Carlo minimization with a solvation correction: Application to an FKBP - substrate complex.
Amedeo CaflischStefan FischerMartin KarplusPublished in: J. Comput. Chem. (1997)
Keyphrases
- monte carlo
- markov chain
- monte carlo simulation
- importance sampling
- monte carlo methods
- monte carlo tree search
- particle filter
- simulation study
- stochastic approximation
- adaptive sampling
- monte carlo method
- game tree search
- optimal strategy
- point processes
- uct algorithm
- reinforcement learning
- quasi monte carlo
- particle filtering
- state space
- objective function