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Optimal Dimensionality Reduction of Multistate Kinetic and Markov-State Models
[Image: see text] We develop a systematic procedure for obtaining rate and transition matrices that optimally describe the dynamics of aggregated superstates formed by combining (clustering or lumping) microstates. These reduced dynamical models are constructed by matching the time-dependent occupan...
| Autores principales: | , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical
Society
2014
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4516310/ https://www.ncbi.nlm.nih.gov/pubmed/25296279 http://dx.doi.org/10.1021/jp508375q |