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The role of solvent-induced forces in biomolecular function and stability

โœ Scribed by D. Bulone; P. L. San Biagio; M. B. Palma-Vittorelli; M. U. Palma

Publisher
Italian Physical Society
Year
1993
Tongue
English
Weight
613 KB
Volume
15
Category
Article
ISSN
0392-6737

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Correlated solvent-induced forces on a p
Correlated solvent-induced forces on a protein at single residue resolution: relation to conformation, stability, dynamics and function
โœ V. Martorana; G. Corongiu; M.U. Palma ๐Ÿ“‚ Article ๐Ÿ“… 1996 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 643 KB

Solvent-induced forces (SIFs) acting on single residues of BPTI (bovine pancreatic trypsin inhibitor) are obtained by molecular dynamics simulations. Our procedure takes into full account the demonstrated inherently strong non-additivity of SIFs. Cross-correlations of instantaneous SIFs on distant r