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Juan Bertrán

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2010 – 2019

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2012
[j4]
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  - journals/jcc/MeliaFMTB12
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Conchín Meliá, Silvia Ferrer, Vicent Moliner, Iñaki Tuñón, Juan Bertrán:
Computational study on hydrolysis of cefotaxime in gas phase and in aqueous solution. J. Comput. Chem. 33(24): 1948-1959 (2012)

2000 – 2009

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2009
[j3]
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Adrià Gil, Mariona Sodupe, Juan Bertrán:
Influence of ionization on the conformational preferences of peptide models. Ramachandran surfaces of N-formyl-glycine amide and N-formyl-alanine amide radical cations. J. Comput. Chem. 30(12): 1771-1784 (2009)
2000
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Jordi Villá, Jörg Bentzien, Àngels González-Lafont, José M. Lluch, Juan Bertrán, Arieh Warshel:
Effective way of modeling chemical catalysis: Empirical valence bond picture of role of solvent and catalyst in alkylation reactions. J. Comput. Chem. 21(8): 607-625 (2000)

1990 – 1999

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1996
[j1]
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Iñaki Tuñón, Manuel F. Ruiz-López, Daniel Rinaldi, Juan Bertrán:
Computation of hydration free energies using a parameterized continuum model: Study of equilibrium geometries and reactive processes in water solution. J. Comput. Chem. 17(2): 148-155 (1996)

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