Longtime convergence of the temperature-accelerated molecular dynamics method
نویسندگان
چکیده
منابع مشابه
Adaptive temperature-accelerated dynamics.
We present three adaptive methods for optimizing the high temperature T(high) on-the-fly in temperature-accelerated dynamics (TAD) simulations. In all three methods, the high temperature is adjusted periodically in order to maximize the performance. While in the first two methods the adjustment depends on the number of observed events, the third method depends on the minimum activation barrier ...
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ژورنال
عنوان ژورنال: Nonlinearity
سال: 2018
ISSN: 0951-7715,1361-6544
DOI: 10.1088/1361-6544/aac541