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 Results for by Rice, L. M.
Searching conformational space
Brunger, A. T., Adams, P. D. and Rice, L. M., International Tables for Crystallography (2012). Vol. F, Section 18.2.4, p. [ doi:10.1107/97809553602060000856 ]
A., Teller, A. & Teller, E. (1953). Equation of state calculations by fast computing machines. J. Chem. Phys . 21, 1087–1092. Google Scholar Rice, L. M. & Brunger, A. T. (1994). Torsion angle dynamics: reduced variable conformational ...

Temperature control
Brunger, A. T., Adams, P. D. and Rice, L. M., International Tables for Crystallography (2012). Vol. F, Section 18.2.4.2, p. [ doi:10.1107/97809553602060000856 ]
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Molecular dynamics
Brunger, A. T., Adams, P. D. and Rice, L. M., International Tables for Crystallography (2012). Vol. F, Section 18.2.4.1, p. [ doi:10.1107/97809553602060000856 ]
 Scholar Jain, A., Vaidehi, N. & Rodriguez, G. (1993). A fast recursive algorithm for molecular dynamics simulation. J. Comput. Phys . 106, 258–268. Google Scholar Rice, L. M. & Brunger, A. T. (1994). Torsion angle ...

An intuitive explanation of simulated annealing
Brunger, A. T., Adams, P. D. and Rice, L. M., International Tables for Crystallography (2012). Vol. F, Section 18.2.4.4, p. [ doi:10.1107/97809553602060000856 ]
of a one-dimensional problem, where the goal is to find the global minimum of a function with multiple minima (Fig. 18.2.4.1) . An intuitive way to understand a molecular-dynamics simulation is to envisage a ball rolling on this one-dimensional surface ...

Annealing schedules
Brunger, A. T., Adams, P. D. and Rice, L. M., International Tables for Crystallography (2012). Vol. F, Section 18.2.4.3, p. [ doi:10.1107/97809553602060000856 ]
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