Interaction of Collagen with Chlorosulphonated Paraffin Tanning Agents: Fourier Transform Infrared Spectroscopic Analysis and Molecular Dynamics Simulations (Articolo in rivista)

Type

• Articolo in rivista (Classe)
• Prodotto della ricerca (Classe)

Label

• Interaction of Collagen with Chlorosulphonated Paraffin Tanning Agents: Fourier Transform Infrared Spectroscopic Analysis and Molecular Dynamics Simulations (Articolo in rivista) (literal)

Anno

• 2013-01-01T00:00:00+01:00 (literal)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#doi

• 10.1039/C3CP52404C (literal)

Alternative label

• S. Monti, E. Bramanti, V. Della Porta, M. Onor, A. D'Ulivo and V. Barone (2013)
  Interaction of Collagen with Chlorosulphonated Paraffin Tanning Agents: Fourier Transform Infrared Spectroscopic Analysis and Molecular Dynamics Simulations
  in Physical chemistry chemical physics (Online); The Royal Society of Chemistry, Cambridge (Regno Unito)
  (literal)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#autori

• S. Monti, E. Bramanti, V. Della Porta, M. Onor, A. D'Ulivo and V. Barone (literal)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#numeroVolume

• in press (literal)

Rivista

• Physical chemistry chemical physics (Rivista)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#affiliazioni

• CNR-ICCOM UOS Pisa Via G. Moruzzi 1 Scuola Normale Superiore Pisa (literal)

Titolo

• Interaction of Collagen with Chlorosulphonated Paraffin Tanning Agents: Fourier Transform Infrared Spectroscopic Analysis and Molecular Dynamics Simulations (literal)

Abstract

• The binding of chlorosulphonated paraffins to collagen triple helices is studied by means of classical molecular dynamics simulations and experimental spectroscopic techniques in order to disclose the principal characteristics of their interaction during the leather fattening process. Indeed, collagen is the main target to develop new leather modifying agents with specific characteristics, and an accurate design of the collagen binders, supported by predictive computational strategies, could be a successful tool to obtain new effective eco-compatible compounds able to impart to the leather the required functionalities and distinctive mechanical properties. Possible effects caused by the tanning agents on the collagen matrix have been identified from both experimental and theoretical points of view. Computational data in agreement with experiment have revealed that chlorosulphonated paraffins can interact favorably with the collagen residues having amine groups in their side chains (Arg, Lys, Asn and Gln) and reduce the tendency of the solvated collagen matrix to swell. However, the interference of chlorosulphonated paraffins with the unfolding process, which is operated mainly by the action of water, can be due both to covalent cross-linking of the collagen chains and intermolecular hydrogen bonding interactions involving also the hydroxyl groups of Hyp, Ser and Thr residues. (literal)

Editore

• The Royal Society of Chemistry (Editore)

Prodotto di

• Costruzione di banche dati di modelling predittivo per sistemi e processi di interesse nei Beni Culturali (PM.P07.015.005) (Modulo)
• Istituto di chimica dei composti organo metallici (ICCOM) (Istituto)

Autore CNR

• ALESSANDRO D'ULIVO (Unità di personale interno)
• MASSIMO ONOR (Persona)
• SUSANNA MONTI (Unità di personale interno)
• EMILIA BRAMANTI (Persona)

Incoming links:

Prodotto

• Istituto di chimica dei composti organo metallici (ICCOM) (Istituto)
• Costruzione di banche dati di modelling predittivo per sistemi e processi di interesse nei Beni Culturali (PM.P07.015.005) (Modulo)

Autore CNR di

• ALESSANDRO D'ULIVO (Unità di personale interno)
• MASSIMO ONOR (Persona)
• EMILIA BRAMANTI (Persona)
• SUSANNA MONTI (Unità di personale interno)

Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#rivistaDi

• Physical chemistry chemical physics (Rivista)

Editore di

• The Royal Society of Chemistry (Editore)