JOSE
SANCHEZ MARIN
CATEDRÁTICO/A DE UNIVERSIDAD
FRANCISCO
TORRENS ZARAGOZA
TITULAR DE UNIVERSIDAD
FRANCISCO TORRENS ZARAGOZA-rekin lankidetzan egindako argitalpenak (15)
2001
-
New dimension indices for the characterization of the solvent-accessible surface
Journal of Computational Chemistry, Vol. 22, Núm. 5, pp. 477-487
1999
-
Interacting induced dipoles polarization model for molecular polarizabilities. Reference molecules, amino acids and model peptides
Journal of Molecular Structure: THEOCHEM, Vol. 463, Núm. 1-2, pp. 27-39
-
Polarization by the effect of a small torsional change in the benzothiazole (A)-benzobisthiazole (B) oligomer A-B13-A
Molecules, Vol. 4, Núm. 1, pp. 28-51
1998
-
AMYR 2: A new version of a computer program for pair potential calculation of molecular associations
Computer Physics Communications, Vol. 115, Núm. 1, pp. 87-89
-
Characterizing cavities in model inclusion molecules: A comparative study
Journal of Molecular Graphics and Modelling, Vol. 16, Núm. 2, pp. 57-71
-
Fractals for hybrid orbitals in protein models
Proceedings - 1998 IEEE International Conference on Information Technology Applications in Biomedicine, ITAB 1998
-
Interacting induced dipoles polarization model for molecular polarizabilities: Application to benzothiazole (A)-benzobisthiazole (B) oligomers A-B13-A
Journal of Molecular Structure: THEOCHEM, Vol. 426, Núm. 1-3, pp. 105-116
-
Universal model for the calculation of all organic solvent-water partition coefficients
Journal of Chromatography A
1996
-
Torsional effects on the molecular polarizabilities of the benzothiazole (A)-benzobisthiazole (B) oligomer A-B13-A
Journal of Molecular Graphics, Vol. 14, Núm. 5, pp. 245-259
1993
-
Are most of the stationary points in a molecular association minima? Application of Fraga's potential to benzene–benzene
Journal of Computational Chemistry, Vol. 14, Núm. 6, pp. 647-654
1992
-
Molecular aggregation of polycyclic aromatic hydrocarbons. A theoretical modelling of coronene aggregation
Journal of Molecular Structure: THEOCHEM, Vol. 254, Núm. C, pp. 429-441
1991
-
Improved AMYR program: an algorithm for the theoretical simulation of molecular associations, including geometrical and topological characterization of the dimers
Journal of Molecular Graphics, Vol. 9, Núm. 4, pp. 254-256
-
Pair potential calculation of molecular associations: a vectorized version
Computer Physics Communications, Vol. 66, Núm. 2-3, pp. 341-362
1988
-
The use of "ab initio" net charges to improve Fraga's atom-atom pair potential for molecular association
Journal of Molecular Structure: THEOCHEM, Vol. 166, Núm. C, pp. 135-140
1987
-
Incorporation of a dispersion energy term to Fraga's atom-atom pair intermolecular potential. Application to benzene, s-tetrazine, and their mixed dimers
Journal of the Chemical Society, Perkin Transactions 2, pp. 943-950