Non-Markovian melting: a novel procedure to generate initial liquid like phases for small molecules for use in computer simulation studies.
Carl McBrideCarlos VegaEduardo SanzPublished in: Comput. Phys. Commun. (2005)
Keyphrases
- simulation study
- reinforcement learning
- monte carlo
- inverted pendulum
- computer systems
- decision processes
- stochastic process
- iterative refinement
- automatically generate
- computer technology
- small number
- computer programming
- generation method
- decision problems
- automatically generating
- mathematical model
- neural network