Lignin as renewable raw material FG Calvo‐Flores, JA Dobado ChemSusChem 3 (11), 1227-1235, 2010 | 1061 | 2010 |
Lignin and lignans as renewable raw materials: chemistry, technology and applications FG Calvo-Flores, JA Dobado, J Isac-García, FJ Martín-Martínez John Wiley & Sons, 2015 | 301 | 2015 |
Green and bio-based solvents FG Calvo-Flores, MJ Monteagudo-Arrebola, JA Dobado, J Isac-García Topics in Current Chemistry 376, 1-40, 2018 | 232 | 2018 |
Chemical Bonding in Hypervalent Molecules Revised. Application of the Atoms in Molecules Theory to Y3 X and Y3 XZ (Y = H or CH3; X = N, P or As; Z = O or S … JA Dobado, H Martínez-García, Molina, MR Sundberg Journal of the American Chemical Society 120 (33), 8461-8471, 1998 | 200 | 1998 |
Weakening C− O bonds: Ti (III), a new reagent for alcohol deoxygenation and carbonyl coupling olefination HR Dieguez, A Lopez, V Domingo, JF Arteaga, JA Dobado, MM Herrador, ... Journal of the American Chemical Society 132 (1), 254-259, 2010 | 162 | 2010 |
CoNTub: An algorithm for connecting two arbitrary carbon nanotubes S Melchor, JA Dobado Journal of chemical information and computer sciences 44 (5), 1639-1646, 2004 | 160 | 2004 |
The three-center-four-electron (3c-4e) bond nature revisited. An atoms-in-molecules theory (AIM) and ELF study J Molina Molina, JA Dobado Theoretical Chemistry Accounts 105, 328-337, 2001 | 140 | 2001 |
Chemical Bonding in Hypervalent Molecules Revised. 3. Application of the Atoms in Molecules Theory to Y3X−CH2 (X = N, P, or As; Y = H or F) and H2X−CH2 (X … JA Dobado, H Martínez-García, Molina, MR Sundberg Journal of the American Chemical Society 122 (6), 1144-1149, 2000 | 130 | 2000 |
Chemical Bonding in Hypervalent Molecules Revised. 2. Application of the Atoms in Molecules Theory to Y2XZ and Y2XZ2 (Y = H, F, CH3; X = O, S, Se; Z = O, S … JA Dobado, H Martínez-García, Molina, MR Sundberg Journal of the American Chemical Society 121 (13), 3156-3164, 1999 | 96 | 1999 |
Basis set superposition error-counterpoise corrected potential energy surfaces. Application to hydrogen peroxide⋯ X (X= F−, Cl−, Br−, Li+, Na+) complexes MC Daza, JA Dobado, JM Molina, P Salvador, M Duran, JL Villaveces The Journal of chemical physics 110 (24), 11806-11813, 1999 | 92 | 1999 |
Emerging pollutants: origin, structure, and properties FG Calvo-Flores, J Isac-García, JA Dobado John Wiley & Sons, 2018 | 83 | 2018 |
Theoretical study on the urea− hydrogen peroxide 1: 1 complexes JA Dobado, J Molina, D Portal The Journal of Physical Chemistry A 102 (4), 778-784, 1998 | 81 | 1998 |
Carbon··· carbon weak interactions I Alkorta, F Blanco, J Elguero, JA Dobado, SM Ferrer, I Vidal The Journal of Physical Chemistry A 113 (29), 8387-8393, 2009 | 74 | 2009 |
On the existence of α-agostic bonds: bonding analyses of titanium alkyl complexes I Vidal, S Melchor, I Alkorta, J Elguero, MR Sundberg, JA Dobado Organometallics 25 (23), 5638-5647, 2006 | 74 | 2006 |
Porous nanotube network: a novel 3-D nanostructured material with enhanced hydrogen storage capacity E Tylianakis, GK Dimitrakakis, S Melchor, JA Dobado, GE Froudakis Chemical communications 47 (8), 2303-2305, 2011 | 68 | 2011 |
On the Nature of Metal−Carbon Bonding: AIM and ELF Analyses of MCHn (n = 1−3) Compounds Containing Early Transition Metals I Vidal, S Melchor, JA Dobado The Journal of Physical Chemistry A 109 (33), 7500-7508, 2005 | 68 | 2005 |
Ab initio molecular orbital study of the hydrogen peroxide-water complex (HOOH. cntdot.. cntdot.. cntdot. H2O) JA Dobado, JM Molina The Journal of Physical Chemistry 98 (7), 1819-1825, 1994 | 56 | 1994 |
Epoxides, cyclic sulfites, and sulfate from natural pentacyclic triterpenoids: theoretical calculations and chemical transformations A García-Granados, PE López, E Melguizo, JN Moliz, A Parra, Y Simeó, ... The Journal of organic chemistry 68 (12), 4833-4844, 2003 | 54 | 2003 |
Dinuclear silver (I) complexes for the design of metal–ligand networks based on triazolopyrimidines AB Caballero, JK Maclaren, A Rodríguez-Diéguez, I Vidal, JA Dobado, ... Dalton Transactions 40 (44), 11845-11855, 2011 | 51 | 2011 |
Recognizing a triple bond between main group atoms J Molina Molina, JA Dobado, GL Heard, RFW Bader, MR Sundberg Theoretical Chemistry Accounts 105, 365-373, 2001 | 51 | 2001 |