Basin-hopping Monte Carlo
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Basin-hopping Monte Carlo [1] [2] is a technique used locate global minima on a potential energy surface.
References[edit]
- ↑ Z. Li and H. A. Scheraga "Monte Carlo-minimization approach to the multiple-minima problem in protein folding", PNAS 84 pp. 6611-6615 (1987)
- ↑ David J. Wales and Jonathan P. K. Doye "Global Optimization by Basin-Hopping and the Lowest Energy Structures of Lennard-Jones Clusters Containing up to 110 Atoms", Journal of Physical Chemistry 101 pp. 5111-5116 (1997)
Related reading
- Jonathan P. K. Doye and David J. Wales "Global minima for transition metal clusters described by Sutton–Chen potentials", New Journal of Chemistry 22 pp. 733-744 (1998)
- C. Shang and D. J. Wales "Communication: Optimal parameters for basin-hopping global optimization based on Tsallis statistics", Journal of Chemical Physics 141 071101 (2014)