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EspcTM: Kinetic Transition Network Based on Trajectory Mapping in Effective Energy Rescaling Space

The transition network provides a key to reveal the thermodynamic and kinetic properties of biomolecular systems. In this paper, we introduce a new method, named effective energy rescaling space trajectory mapping (EspcTM), to detect metastable states and construct transition networks based on the s...

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Detalles Bibliográficos
Autores principales: Wang, Zhenyu, Zhou, Xin, Zuo, Guanghong
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Frontiers Media S.A. 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7653181/
https://www.ncbi.nlm.nih.gov/pubmed/33195438
http://dx.doi.org/10.3389/fmolb.2020.589718