The Multiple-Minima Problem in Small Peptides Revisited. The Threshold Accepting Approach
- 1 April 1992
- journal article
- research article
- Published by Taylor & Francis in Journal of Biomolecular Structure and Dynamics
- Vol. 9 (5) , 951-957
- https://doi.org/10.1080/07391102.1992.10507969
Abstract
A recently reported optimization method, known as Threshold Accepting, was tested for the purpose of locating the structure of several peptide molecules with the lowest conformational energy. A comparison with previous results obtained with the Simulated Annealing technique was made. Our study indicate Threshold Accepting as a better technique in locating such structures.Keywords
This publication has 3 references indexed in Scilit:
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- Threshold accepting: A general purpose optimization algorithm appearing superior to simulated annealingJournal of Computational Physics, 1990
- Energy parameters in polypeptides. 9. Updating of geometrical parameters, nonbonded interactions, and hydrogen bond interactions for the naturally occurring amino acidsThe Journal of Physical Chemistry, 1983