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Miquel Duran: [Publications] [Author Rank by year] [Co-authors] [Prefers] [Cites] [Cited by]
Publications of Author
- Marta Forés, Miquel Duran, Miquel Solà, Ludwik Adamowicz
Theoretical characterization of intramolecular proton transfer in the ground and the lowest-lying triplet excited states of 1-amino-3-propenal: a methodological comparison. [Citation Graph (0, 0)][DBLP]
Journal of Computational Chemistry, 2000, v:21, n:4, pp:257-269 [Journal] - Xavier Fradera, Miquel Duran, Jordi Mestres
Atomic transferability within the exchange-correlation density. [Citation Graph (0, 0)][DBLP]
Journal of Computational Chemistry, 2000, v:21, n:15, pp:1361-1374 [Journal] - Jordi Mestres, Miquel Solà, Miquel Duran, Ramon Carbó
On the Calculation of Ab Initio Quantum Molecular Similarities for Large Systems: Fitting the Electron Density. [Citation Graph (0, 0)][DBLP]
Journal of Computational Chemistry, 1994, v:15, n:10, pp:1113-1120 [Journal] - Béla Paizs, Pedro Salvador, Attila G. Császár, Miquel Duran, Sándor Suhai
Intermolecular bond lengths: extrapolation to the basis set limit on uncorrected and BSSE-corrected potential energy hypersurfaces. [Citation Graph (0, 0)][DBLP]
Journal of Computational Chemistry, 2001, v:22, n:2, pp:196-207 [Journal] - Jordi Poater, Miquel Duran, Miquel Solà
Parametrization of the Becke3-LYP hybrid functional for a series of small molecules using quantum molecular similarity techniques. [Citation Graph (0, 0)][DBLP]
Journal of Computational Chemistry, 2001, v:22, n:14, pp:1666-1678 [Journal] - Pedro Salvador, Béla Paizs, Miquel Duran, Sándor Suhai
On the effect of the BSSE on intermolecular potential energy surfaces. Comparison of a priori and a posteriori BSSE correction schemes. [Citation Graph (0, 0)][DBLP]
Journal of Computational Chemistry, 2001, v:22, n:7, pp:765-786 [Journal] - Miquel Solà, Jordi Mestres, Miquel Duran, Ramon Carbó
Ab Initio Quantum Molecular Similarity Measures on Metal-Substituted Carbonic Anhydrase (MIICA, M = Be, Mg, Mn, Co, Ni, Cu, Zn, and Cd). [Citation Graph (0, 0)][DBLP]
Journal of Chemical Information and Computer Sciences, 1994, v:34, n:5, pp:1047-1053 [Journal]
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