Modular assembly of proteins on nanoparticles
Ma, Wenwei, Saccardo, Angela, Roccatano, Danilo, Aboagye-Mensah, Dorothy, Alkaseem, Mohammad, Jewkes, Matthew, Di Nezza, Francesca, Baron, Mark, Soloviev, Mikhail, Ferrari, Enrico
Published in Nature communications (16.04.2018)
Published in Nature communications (16.04.2018)
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Journal Article
Molecular dynamics simulation study of solvent effects on conformation and dynamics of polyethylene oxide and polypropylene oxide chains in water and in common organic solvents
Hezaveh, Samira, Samanta, Susruta, Milano, Giuseppe, Roccatano, Danilo
Published in The Journal of chemical physics (28.03.2012)
Published in The Journal of chemical physics (28.03.2012)
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Journal Article
Structure and dynamics of 1,2-dimethoxyethane and 1,2-dimethoxypropane in aqueous and non-aqueous solutions: a molecular dynamics study
Hezaveh, Samira, Samanta, Susruta, Milano, Giuseppe, Roccatano, Danilo
Published in The Journal of chemical physics (28.10.2011)
Published in The Journal of chemical physics (28.10.2011)
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Journal Article
Directed evolution of a highly active Yersinia mollaretii phytase
Shivange, Amol V., Serwe, Annegret, Dennig, Alexander, Roccatano, Danilo, Haefner, Stefan, Schwaneberg, Ulrich
Published in Applied microbiology and biotechnology (01.07.2012)
Published in Applied microbiology and biotechnology (01.07.2012)
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Journal Article
Hybrid Particle-Field Coarse-Grained Models for Biological Phospholipids
De Nicola, Antonio, Zhao, Ying, Kawakatsu, Toshihiro, Roccatano, Danilo, Milano, Giuseppe
Published in Journal of chemical theory and computation (13.09.2011)
Published in Journal of chemical theory and computation (13.09.2011)
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Journal Article
Mechanism by Which 2,2,2-Trifluoroethanol/Water Mixtures Stabilize Secondary-Structure Formation in Peptides: A Molecular Dynamics Study
Roccatano, Danilo, Colombo, Giorgio, Fioroni, Marco, Mark, Alan E.
Published in Proceedings of the National Academy of Sciences - PNAS (17.09.2002)
Published in Proceedings of the National Academy of Sciences - PNAS (17.09.2002)
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Journal Article
Spontaneous insertion of carbon nanotube bundles inside biomembranes: A hybrid particle-field coarse-grained molecular dynamics study
Sarukhanyan, Edita, De Nicola, Antonio, Roccatano, Danilo, Kawakatsu, Toshihiro, Milano, Giuseppe
Published in Chemical physics letters (18.03.2014)
Published in Chemical physics letters (18.03.2014)
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Journal Article
Validation of a hybrid MD-SCF coarse-grained model for DPPC in non-lamellar phases
De Nicola, Antonio, Zhao, Ying, Kawakatsu, Toshihiro, Roccatano, Danilo, Milano, Giuseppe
Published in Theoretical chemistry accounts (01.03.2012)
Published in Theoretical chemistry accounts (01.03.2012)
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Journal Article
A Statistical Analysis of Random Mutagenesis Methods Used for Directed Protein Evolution
Wong, Tuck Seng, Roccatano, Danilo, Zacharias, Martin, Schwaneberg, Ulrich
Published in Journal of molecular biology (27.01.2006)
Published in Journal of molecular biology (27.01.2006)
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Journal Article
P450 BM3 crystal structures reveal the role of the charged surface residue Lys/Arg184 in inversion of enantioselective styrene epoxidation
Shehzad, Aamir, Panneerselvam, Saravanan, Linow, Marina, Bocola, Marco, Roccatano, Danilo, Mueller-Dieckmann, Jochen, Wilmanns, Matthias, Schwaneberg, Ulrich
Published in Chemical communications (Cambridge, England) (01.01.2013)
Published in Chemical communications (Cambridge, England) (01.01.2013)
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Journal Article
Effect of hexafluoroisopropanol alcohol on the structure of melittin: A molecular dynamics simulation study
Roccatano, Danilo, Fioroni, Marco, Zacharias, Martin, Colombo, Giorgio
Published in Protein science (01.10.2005)
Published in Protein science (01.10.2005)
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Journal Article
Extended Molecular Dynamics Simulation of the Carbon Monoxide Migration in Sperm Whale Myoglobin
Bossa, Cecilia, Anselmi, Massimiliano, Roccatano, Danilo, Amadei, Andrea, Vallone, Beatrice, Brunori, Maurizio, Di Nola, Alfredo
Published in Biophysical journal (01.06.2004)
Published in Biophysical journal (01.06.2004)
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Journal Article