2009 |
8 | EE | Albert Poater,
Ana Gallegos Saliner,
Ramon Carbó-Dorca,
Jordi Poater,
Miquel Solà,
Luigi Cavallo,
Andrew P. Worth:
Modeling the structure-property relationships of nanoneedles: A journey toward nanomedicine.
Journal of Computational Chemistry 30(2): 275-284 (2009) |
7 | EE | Ramon Carbó-Dorca,
Ana Gallegos,
Ángel J. Sánchez:
Notes on quantitative structure-properties relationships (QSPR) (1): A discussion on a QSPR dimensionality paradox (QSPR DP) and its quantum resolution.
Journal of Computational Chemistry 30(7): 1146-1159 (2009) |
2006 |
6 | EE | Noel Ferro,
Ana Gallegos,
Patrick Bultinck,
Hans-Jörg Jacobsen,
Ramon Carbó-Dorca,
Thomas Reinard:
Coulomb and Overlap Self-Similarities: A Comparative Selectivity Analysis of Structure-Function Relationships for Auxin-like Molecules.
Journal of Chemical Information and Modeling 46(4): 1751-1762 (2006) |
2005 |
5 | EE | Ana Gallegos,
Ramon Carbó-Dorca,
François Lodier,
Eric Cancès,
Andreas Savin:
Maximal probability domains in linear molecules.
Journal of Computational Chemistry 26(5): 455-460 (2005) |
2003 |
4 | EE | Ana Gallegos Saliner,
Lluís Amat,
Ramon Carbó-Dorca,
T. Wayne Schultz,
Mark T. D. Cronin:
Molecular Quantum Similarity Analysis of Estrogenic Activity.
Journal of Chemical Information and Computer Sciences 43(4): 1166-1176 (2003) |
2001 |
3 | EE | Ana Gallegos Saliner,
David Robert,
Xavier Gironés,
Ramon Carbó-Dorca:
Structure-toxicity relationships of polycyclic aromatic hydrocarbons using molecular quantum similarity.
Journal of Computer-Aided Molecular Design 15(1): 67-80 (2001) |
2 | EE | Xavier Gironés,
Ana Gallegos Saliner,
Ramon Carbó-Dorca:
Antimalarial activity of synthetic 1, 2, 4-trioxanes and cyclic peroxy ketals, a quantum similarity study.
Journal of Computer-Aided Molecular Design 15(12): 1053-1063 (2001) |
2000 |
1 | EE | Xavier Gironés,
Ana Gallegos Saliner,
Ramon Carbó-Dorca:
Modeling Antimalarial Activity: Application of Kinetic Energy Density Quantum Similarity Measures as Descriptors in QSAR.
Journal of Chemical Information and Computer Sciences 40(6): 1400-1407 (2000) |