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Conformation sampling minimum perturbation method

The systematic, or grid, search is only possible for small molecules. For larger systems tlrere are methods which can be used for perturbing a geometry from a local minimum to another minimum. Some commonly used methods for conformational sampling are ... [Pg.340]


See other pages where Conformation sampling minimum perturbation method is mentioned: [Pg.178]    [Pg.166]    [Pg.115]    [Pg.383]    [Pg.110]    [Pg.263]   
See also in sourсe #XX -- [ Pg.286 ]




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Method, perturbational

Minimum perturbation method

Perturbation method

Perturbative methods

Sample methods

Sampling methods

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