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A fast method for the determination of fractional contributions to solvation in proteins

A fast method for the calculation of residue contributions to protein solvation is presented. The approach uses the exposed polar and apolar surface of protein residues and has been parametrized from the fractional contributions to solvation determined from linear response theory coupled to molecula...

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Détails bibliographiques
Auteurs principaux: Talavera, David, Morreale, Antonio, Meyer, Tim, Hospital, Adam, Ferrer-Costa, Carles, Gelpi, Josep Lluis, de la Cruz, Xavier, Soliva, Robert, Luque, F. Javier, Orozco, Modesto
Format: Artigo
Langue:Inglês
Publié: Blackwell Publishing 2006
Sujets:
Accès en ligne:https://ncbi.nlm.nih.gov/pmc/articles/PMC2242413/
https://ncbi.nlm.nih.gov/pubmed/17001031
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1110/ps.062406706
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