An integrate-over-temperature approach for enhanced sampling
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.2825614
Reference34 articles.
1. Novel methods of sampling phase space in the simulation of biological systems
2. Reducing quasi‐ergodic behavior in Monte Carlo simulations by J‐walking: Applications to atomic clusters
3. Probability Distributions for Complex Systems: Adaptive Umbrella Sampling of the Potential Energy
4. Replica-exchange molecular dynamics method for protein folding
5. Multidimensional replica-exchange method for free-energy calculations
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