Nuno Micaêlo, PhD
Molecular dynamics simulations of biomolecular systems
 
 
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Protein structure and dynamics in ionic liquids PDF Print E-mail
Micaelo, N.M., Soares, C.M. (2008) "Protein structure and dynamics in ionic liquids. Insights from molecular dynamics simulation studies", J.Phys.Chem.B, in press
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Protein thermal stabilization by charged compatible solutes PDF Print E-mail
Micaelo N.M., Victor B.L., Soares C.S. (2008) “Protein thermal stabilization by charged compatible solutes. Computational studies in rubredoxin from Desulfovibrio gigas”, Proteins: Structure, function and bioinformatics. in press
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Modelling study of the hydration mechanism of enzymes in nonpolar and polar organic solvents PDF Print E-mail

Micaelo N.M., Soares C.S. (2007) “Modelling study of the hydration mechanism of enzymes in nonpolar and polar organic solvents”, FEBS J., 274, 2424-2436 (Cover image )

 

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Tailoring cutinase activity towards polyethylene terephthalate and polyamide 6.6 fibers PDF Print E-mail

Araújo R., Silva C., O’Neill A., Micaelo N.M., Guebitz G., Soares C.M., Casal M., Cavaco-Paulo A. (2007) "Tailoring cutinase activity towards polyethylene terephthalate and polyamide 6.6 fibers", J. of Biotech., 128, 849-857 

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Parameterization of 1-Butyl-3-Methylimidazolium Hexafluorophosphate/Nitrate Ionic Liquids PDF Print E-mail
Micaelo, N.M., Baptista, A.M., Soares, C.M. (2007) "Parameterization of 1-Butyl-3-Methylimidazolium Hexafluorophosphate/Nitrate Ionic Liquid for the GROMOS force field", J.Phys.Chem.B, 110, 14444-14451
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