想象 发表于 2025-3-26 21:23:42

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受人支配 发表于 2025-3-27 03:00:50

Uncertainty Estimation,s direct comparison with experiments as well as the elucidation of mechanistic pathways for an inherently stochastic process. A vital part of meaningful comparison with experiment is the characterization of the statistical uncertainty in the predicted experimental measurement, which may take the for

金盘是高原 发表于 2025-3-27 08:37:53

Analysis of Markov Models,operties of the molecular system studied, approximated on the discrete state space. Thus, many quantities of interest to the molecular scientist can now be calculated from the Markov model transition matrix rather than from a “direct” analysis of the underlying simulation data. The advantage over a

APNEA 发表于 2025-3-27 10:58:51

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捕鲸鱼叉 发表于 2025-3-27 15:11:46

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前奏曲 发表于 2025-3-27 21:15:08

Textbook 2014tanding. Additionally, MSMs facilitate the calculation of quantities that are difficult to obtain from more direct MD analyses, such as the ensemble of transition pathways..This book introduces the mathematical foundations of Markov models, how they can be used to analyze simulations and drive effic

令人作呕 发表于 2025-3-27 22:56:11

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阉割 发表于 2025-3-28 04:57:41

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Delirium 发表于 2025-3-28 07:06:19

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peptic-ulcer 发表于 2025-3-28 11:14:57

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查看完整版本: Titlebook: An Introduction to Markov State Models and Their Application to Long Timescale Molecular Simulation; Gregory R. Bowman,Vijay S. Pande,Fran