Correlative motions and memory effects in molecular dynamics simulations of molecules: principal components and rescaled range analysis suggest that the motions of native BPTI are more correlated than those of its mutants.

Saarela, Janne T A

Correlative motions and memory effects in molecular dynamics simulations of molecules: principal components and rescaled range analysis suggest that the motions of native BPTI are more correlated than those of its mutants. [electronic resource] - Biophysical chemistry Jan 2002 - 49-57 p. digital

Publication Type: Journal Article; Research Support, Non-U.S. Gov't

0301-4622

10.1016/s0301-4622(01)00250-2 doi


Algorithms
Aprotinin--chemistry
Chemical Phenomena
Chemistry, Physical
Energy Transfer
Models, Molecular
Muramidase--chemistry
Protein Conformation
Thermodynamics