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Improvements and new functionalities of UNRES server for coarse-grained modeling of protein structure, dynamics, and interactions
In this paper we report the improvements and extensions of the UNRES server (https://unres-server.chem.ug.edu.pl) for physics-based simulations with the coarse-grained UNRES model of polypeptide chains. The improvements include the replacement of the old code with the recently optimized one and addi...
Autores principales: | Ślusarz, Rafał, Lubecka, Emilia A., Czaplewski, Cezary, Liwo, Adam |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Frontiers Media S.A.
2022
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9794589/ https://www.ncbi.nlm.nih.gov/pubmed/36589235 http://dx.doi.org/10.3389/fmolb.2022.1071428 |
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