| Medicinal chemistry and bioinformatics-current trends in drugs discovery with networks topological indices H Gonzalez-Diaz, S Vilar, L Santana, E Uriarte Current topics in medicinal chemistry 7 (10), 1015-1029, 2007 | 366 | 2007 |
| Proteomics, networks and connectivity indices H González‐Díaz, Y González‐Díaz, L Santana, FM Ubeira, E Uriarte Proteomics 8 (4), 750-778, 2008 | 305 | 2008 |
| Unified QSAR approach to antimicrobials. Part 3: first multi-tasking QSAR model for input-coded prediction, structural back-projection, and complex networks clustering of … FJ Prado-Prado, H González-Díaz, OM de la Vega, FM Ubeira, KC Chou Bioorganic & medicinal chemistry 16 (11), 5871-5880, 2008 | 225 | 2008 |
| A QSAR model for in silico screening of MAO-A inhibitors. Prediction, synthesis, and biological assay of novel coumarins L Santana, E Uriarte, H González-Díaz, G Zagotto, R Soto-Otero, ... Journal of medicinal chemistry 49 (3), 1149-1156, 2006 | 190 | 2006 |
| Predicting antimicrobial drugs and targets with the MARCH-INSIDE approach H González-Díaz, F Prado-Prado, FM Ubeira Current topics in medicinal chemistry 8 (18), 1676-1690, 2008 | 177 | 2008 |
| Computer-aided nanotoxicology: assessing cytotoxicity of nanoparticles under diverse experimental conditions by using a novel QSTR-perturbation approach F Luan, VV Kleandrova, H González-Díaz, JM Ruso, A Melo, ... Nanoscale 6 (18), 10623-10630, 2014 | 149 | 2014 |
| Multi-target spectral moment QSAR versus ANN for antiparasitic drugs against different parasite species FJ Prado-Prado, X García-Mera, H González-Díaz Bioorganic & medicinal chemistry 18 (6), 2225-2231, 2010 | 149 | 2010 |
| Computational tool for risk assessment of nanomaterials: Novel QSTR-perturbation model for simultaneous prediction of ecotoxicity and cytotoxicity of uncoated and coated … VV Kleandrova, F Luan, H Gonzalez-Diaz, JM Ruso, A Speck-Planche, ... Environmental science & technology 48 (24), 14686-14694, 2014 | 144 | 2014 |
| Quantitative structure− activity relationship and complex network approach to monoamine oxidase A and B inhibitors L Santana, H Gonzalez-Diaz, E Quezada, E Uriarte, M Yanez, D Vina, ... Journal of Medicinal Chemistry 51 (21), 6740-6751, 2008 | 144 | 2008 |
| Unified QSAR approach to antimicrobials. 4. Multi-target QSAR modeling and comparative multi-distance study of the giant components of antiviral drug–drug complex networks FJ Prado-Prado, OM de la Vega, E Uriarte, FM Ubeira, KC Chou, ... Bioorganic & medicinal chemistry 17 (2), 569-575, 2009 | 133 | 2009 |
| Computational ecotoxicology: Simultaneous prediction of ecotoxic effects of nanoparticles under different experimental conditions VV Kleandrova, F Luan, H González-Díaz, JM Ruso, A Melo, ... Environment international 73, 288-294, 2014 | 130 | 2014 |
| Novel 2D maps and coupling numbers for protein sequences. The first QSAR study of polygalacturonases; isolation and prediction of a novel sequence from Psidium guajava L. G Agüero-Chapin, H González-Díaz, R Molina, J Varona-Santos, ... FEBS letters 580 (3), 723-730, 2006 | 127 | 2006 |
| Unified QSAR and network‐based computational chemistry approach to antimicrobials, part 1: Multispecies activity models for antifungals H GonzÁlez‐DÍaz, FJ Prado‐Prado Journal of computational chemistry 29 (4), 656-667, 2008 | 126 | 2008 |
| Alignment-free prediction of a drug− target complex network based on parameters of drug connectivity and protein sequence of receptors D Vina, E Uriarte, F Orallo, H Gonzalez-Diaz Molecular pharmaceutics 6 (3), 825-835, 2009 | 125 | 2009 |
| 3D-Chiral quadratic indices of the ‘molecular pseudograph’s atom adjacency matrix’and their application to central chirality codification: classification of ACE inhibitors and … YM Ponce, HG Dı́az, VR Zaldivar, F Torrens, EA Castro Bioorganic & medicinal chemistry 12 (20), 5331-5342, 2004 | 122 | 2004 |
| General theory for multiple input-output perturbations in complex molecular systems. 1. Linear QSPR electronegativity models in physical, organic, and medicinal chemistry H Gonzalez-Diaz, S Arrasate, A Gomez-SanJuan, N Sotomayor, E Lete, ... Current topics in medicinal chemistry 13 (14), 1713-1741, 2013 | 118 | 2013 |
| HP-Lattice QSAR for dynein proteins: experimental proteomics (2D-electrophoresis, mass spectrometry) and theoretic study of a Leishmania infantum sequence MA Dea-Ayuela, Y Pérez-Castillo, A Meneses-Marcel, FM Ubeira, ... Bioorganic & medicinal chemistry 16 (16), 7770-7776, 2008 | 113 | 2008 |
| 3D-MEDNEs: an alternative “in silico” technique for chemical research in toxicology. 1. prediction of chemically induced agranulocytosis HG Díaz, Y Marrero, I Hernández, I Bastida, E Tenorio, O Nasco, E Uriarte, ... Chemical research in toxicology 16 (10), 1318-1327, 2003 | 106 | 2003 |
| MIND-BEST: Web Server for Drugs and Target Discovery; Design, Synthesis, and Assay of MAO-B Inhibitors and Theoretical− Experimental Study of G3PDH Protein from Trichomonas … H González-Díaz, F Prado-Prado, X García-Mera, N Alonso, P Abeijón, ... Journal of proteome research 10 (4), 1698-1718, 2011 | 105 | 2011 |
| A new topological descriptors based model for predicting intestinal epithelial transport of drugs in Caco-2 cell culture YM Ponce, MAC Perez, VR Zaldivar, HG Diaz, F Torrens J Pharm Pharm Sci 7 (2), 186-199, 2004 | 101 | 2004 |
Cristian R. MunteanuRNASA-IMEDIR, CITIC, University of A Coruna, INIBICVerified email at udc.es
