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Network models for molecular kinetics and their initial applications to human health 被引量:1
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作者 Gregory R Bowman Xuhui Huang vijay s pande 《Cell Research》 SCIE CAS CSCD 2010年第6期622-630,共9页
Molecular kinetics underlies all biological phenomena and, like many other biological processes, may best be understood in terms of networks. These networks, called Markov state models (MSMs), are typically built fr... Molecular kinetics underlies all biological phenomena and, like many other biological processes, may best be understood in terms of networks. These networks, called Markov state models (MSMs), are typically built from physical simulations. Thus, they are capable of quantitative prediction of experiments and can also provide an intuition for complex couformational changes. Their primary application has been to protein folding; however, these technologies and the insights they yield are transferable. For example, MSMs have already proved useful in understanding human diseases, such as protein misfolding and aggregation in Alzheimer's disease. 展开更多
关键词 Markov state models molecular dynamics simulations protein folding conformational change Alzheimer's disease
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