selected publications
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academic article
- Molecular dinamic study of subtilisin Carlsberg in aqueous and nonaqueous solvents. Molecular Simulation. 35. 2009
- Effects of Active Site Mutations in Hemoglobin I from Lucina Pectinata: a Molecular Dynamic Study. Molecular Simulation. 34:715-725. 2008
- Study of Magnesium Diboride Clusters Using Hybrid Density Functional Theory. Research Letters in Physics. 2008
- Phase equilibria in model surfactants forming langmuir monolayers. J. Chem. Phys. 127. 2007
- Molecular dynamics of surfactant protein C (SP-C): From single molecule to heptameric aggregates. Biophys. J. . 90. 2006
- Quantum dissociation dynamics of H2 and D2 on a Ni13 cluster. J. Chem. Phys. 107:1420. 1997
- The dynamics of matrix trapping: I. Deposition of a pure argon matrix,. J. Chem. Phys. 104:4294. 1996
- The dynamics of matrix trapping: II. Simple spherical species trapped in a rare gas matrix. J. Chem. Phys. 104:4301. 1996
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article
- Thermodynamics of the Liquid States of Langmuir Monolayers. J. Chem. Phys. 122:104701-104707. 2005
- Conformational Changes in a Model Helical Peptide: A Parallel Tempering Monte Carlo Study. J. Chem. Phys. 119:9274-9279. 2003