FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2051330221> ?p ?o ?g. }

• W2051330221 endingPage "568" @default.
• W2051330221 startingPage "558" @default.
• W2051330221 abstract "Proteins adsorption at solid surfaces are of paramount important for many natural processes. However, the role of specific water in influencing the adsorption process has not been well understood. We used molecular dynamics simulation to study the adsorption of BPTI on Au surface in three water environments (dielectric constant model, partial and full solvation models). The result shows that a fast and strong adsorption can occur in the dielectric environment, which leads to significant structure changes, as confirmed by great deviation from the crystal structure, largely spreading along the Au surface, rapid lose in all secondary structures and the great number of atoms in contact with the surface. Compared to the dielectric model, slower adsorption and fewer changes in the calculated properties above are observed in the partial solvation system since the specific water layer weakens the adsorption effects. However, in the partial solvation system, the adsorption of polar Au surface causes a significant decrease in the specific hydration around the protein, which still results in large structure changes similar to the dielectric system, but with much less adsorption extent. Enough water molecules in the full solvation system could allow the protein to rotate, and to large extent preserve the protein native structure, thus leading to the slowest and weakest adsorption. On the whole, the effects of non-specific and specific solvation on the protein structure and adsorption dynamics are significantly different, highlighting the importance of the specific water molecule in the protein adsorption." @default.
• W2051330221 created "2016-06-24" @default.
• W2051330221 creator A5033243558 @default.
• W2051330221 creator A5037593812 @default.
• W2051330221 creator A5046182390 @default.
• W2051330221 creator A5085405859 @default.
• W2051330221 creator A5091660325 @default.
• W2051330221 date "2013-10-01" @default.
• W2051330221 modified "2023-09-22" @default.
• W2051330221 title "Effects of Non-specific and Specific Solvation on Adsorption of BPTI on Au Surface: Insight from Molecular Dynamics Simulation" @default.
• W2051330221 cites W1963684165 @default.
• W2051330221 cites W1964646276 @default.
• W2051330221 cites W1969703068 @default.
• W2051330221 cites W1971251199 @default.
• W2051330221 cites W1975088956 @default.
• W2051330221 cites W1976499671 @default.
• W2051330221 cites W1982342638 @default.
• W2051330221 cites W1984815069 @default.
• W2051330221 cites W1989687642 @default.
• W2051330221 cites W1996714181 @default.
• W2051330221 cites W1999097992 @default.
• W2051330221 cites W2001109559 @default.
• W2051330221 cites W2004840370 @default.
• W2051330221 cites W2008708467 @default.
• W2051330221 cites W2014445318 @default.
• W2051330221 cites W2016022695 @default.
• W2051330221 cites W2029667189 @default.
• W2051330221 cites W2034941626 @default.
• W2051330221 cites W2035946954 @default.
• W2051330221 cites W2037839062 @default.
• W2051330221 cites W2040533100 @default.
• W2051330221 cites W2042060162 @default.
• W2051330221 cites W2044043868 @default.
• W2051330221 cites W2046427711 @default.
• W2051330221 cites W2051809212 @default.
• W2051330221 cites W2060259421 @default.
• W2051330221 cites W2063517142 @default.
• W2051330221 cites W2070579594 @default.
• W2051330221 cites W2077024385 @default.
• W2051330221 cites W2085397786 @default.
• W2051330221 cites W2086566412 @default.
• W2051330221 cites W2090022310 @default.
• W2051330221 cites W2093067271 @default.
• W2051330221 cites W2115880199 @default.
• W2051330221 cites W2118027253 @default.
• W2051330221 cites W2123998092 @default.
• W2051330221 cites W2128392700 @default.
• W2051330221 cites W2129521473 @default.
• W2051330221 cites W2157046483 @default.
• W2051330221 cites W2319213976 @default.
• W2051330221 cites W2324033720 @default.
• W2051330221 cites W2332917072 @default.
• W2051330221 cites W2334740869 @default.
• W2051330221 doi "https://doi.org/10.1063/1674-0068/26/05/558-568" @default.
• W2051330221 hasPublicationYear "2013" @default.
• W2051330221 type Work @default.
• W2051330221 sameAs 2051330221 @default.
• W2051330221 citedByCount "0" @default.
• W2051330221 crossrefType "journal-article" @default.
• W2051330221 hasAuthorship W2051330221A5033243558 @default.
• W2051330221 hasAuthorship W2051330221A5037593812 @default.
• W2051330221 hasAuthorship W2051330221A5046182390 @default.
• W2051330221 hasAuthorship W2051330221A5085405859 @default.
• W2051330221 hasAuthorship W2051330221A5091660325 @default.
• W2051330221 hasConcept C119049451 @default.
• W2051330221 hasConcept C133386390 @default.
• W2051330221 hasConcept C147597530 @default.
• W2051330221 hasConcept C147789679 @default.
• W2051330221 hasConcept C148093993 @default.
• W2051330221 hasConcept C149823470 @default.
• W2051330221 hasConcept C150394285 @default.
• W2051330221 hasConcept C159467904 @default.
• W2051330221 hasConcept C178790620 @default.
• W2051330221 hasConcept C185592680 @default.
• W2051330221 hasConcept C192562407 @default.
• W2051330221 hasConcept C32909587 @default.
• W2051330221 hasConcept C49040817 @default.
• W2051330221 hasConcept C59593255 @default.
• W2051330221 hasConcept C64147673 @default.
• W2051330221 hasConcept C88001094 @default.
• W2051330221 hasConceptScore W2051330221C119049451 @default.
• W2051330221 hasConceptScore W2051330221C133386390 @default.
• W2051330221 hasConceptScore W2051330221C147597530 @default.
• W2051330221 hasConceptScore W2051330221C147789679 @default.
• W2051330221 hasConceptScore W2051330221C148093993 @default.
• W2051330221 hasConceptScore W2051330221C149823470 @default.
• W2051330221 hasConceptScore W2051330221C150394285 @default.
• W2051330221 hasConceptScore W2051330221C159467904 @default.
• W2051330221 hasConceptScore W2051330221C178790620 @default.
• W2051330221 hasConceptScore W2051330221C185592680 @default.
• W2051330221 hasConceptScore W2051330221C192562407 @default.
• W2051330221 hasConceptScore W2051330221C32909587 @default.
• W2051330221 hasConceptScore W2051330221C49040817 @default.
• W2051330221 hasConceptScore W2051330221C59593255 @default.
• W2051330221 hasConceptScore W2051330221C64147673 @default.
• W2051330221 hasConceptScore W2051330221C88001094 @default.
• W2051330221 hasIssue "5" @default.
• W2051330221 hasLocation W20513302211 @default.

• next