Insights into Ligand–Protein Binding from Local Mechanical Response

Computational studies of ligand–protein binding are crucial for properly designing novel compounds of potential pharmacological interest. In this respect, researchers are increasingly interested in steered molecular dynamics for ligand–protein binding and unbinding studies. In particular, it has bee...

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Detalles Bibliográficos
Autores principales: Patel, Jagdish Suresh, Branduardi, Davide, Masetti, Matteo, Rocchia, Walter, Cavalli, Andrea
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2011
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3191767/
https://www.ncbi.nlm.nih.gov/pubmed/22003321
http://dx.doi.org/10.1021/ct200324j

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3191767/
https://www.ncbi.nlm.nih.gov/pubmed/22003321
http://dx.doi.org/10.1021/ct200324j

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