Global optimization using bad derivatives: Derivative-free method for molecular energy minimization

Author:

Andricioaei Ioan,Straub John E.

Publisher

Wiley

Subject

Computational Mathematics,General Chemistry

Reference28 articles.

1. and Simulated Annealing and Boltzmann Machines, Wiley, New York, 1989.

2. and Eds. Global Minimization of Nonconvex Energy Functions: Molecular Conformation and Protein Folding, American Mathematical Society, Providence, RI, 1996.

3. (personal communication): incidentally, a similar approximation gives the correct long-time survival probability of the random walk in first passage time problems.

4. On the multiple-minima problem in the conformational analysis of molecules: deformation of the potential energy hypersurface by the diffusion equation method

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