Issue 21, 1991

ANNEAL-RING: a new algorithm for optimization of rings using simulated annealing

Abstract

The exact calculation of the six dependent dihedrals in rings allows smooth deformation by computer and the application of simulated annealing to the location of the global minimum of rings.

Article information

Article type
Paper

J. Chem. Soc., Chem. Commun., 1991, 1542-1543

ANNEAL-RING: a new algorithm for optimization of rings using simulated annealing

F. Guarnieri, W. Cui and S. R. Wilson, J. Chem. Soc., Chem. Commun., 1991, 1542 DOI: 10.1039/C39910001542

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