Independent clusters in coordinate space: an efficient alternative to shell-model expansion
نویسندگان
چکیده
منابع مشابه
Efficient sampling in collective coordinate space.
Collective motions in biological macromolecules have been shown to be important for function. The most important collective motions occur on slow time scales, which poses a sampling problem in dynamic simulation of biomolecules. We present a novel method for efficient conformational sampling. The method combines the simulation of an ensemble of concurrent trajectories with restraints acting on ...
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ژورنال
عنوان ژورنال: Journal of Physics G: Nuclear and Particle Physics
سال: 1991
ISSN: 0954-3899,1361-6471
DOI: 10.1088/0954-3899/17/6/008