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gRINN: a tool for calculation of residue interaction energies and protein energy network analysis of molecular dynamics simulations

Atomistic molecular dynamics (MD) simulations generate a wealth of information related to the dynamics of proteins. If properly analyzed, this information can lead to new insights regarding protein function and assist wet-lab experiments. Aiming to identify interactions between individual amino acid...

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Detalles Bibliográficos
Autores principales: Serçinoğlu, Onur, Ozbek, Pemra
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Oxford University Press 2018
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6030995/
https://www.ncbi.nlm.nih.gov/pubmed/29800260
http://dx.doi.org/10.1093/nar/gky381