# | Title | Journal | Year | Citations |
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1 | Electrochemical impedance spectroscopy for studying passive layers on steel rebars immersed in alkaline solutions simulating concrete pores | Electrochimica Acta | 2007 | 197 |
2 | Topological Approach to Drug Design | Journal of Chemical Information and Computer Sciences | 1995 | 182 |
3 | Origin invariant calculation of optical rotation without recourse to London orbitals | Chemical Physics Letters | 2004 | 156 |
4 | Designing sedative/hypnotic compounds from a novel substructural graph-theoretical approach | Journal of Computer-Aided Molecular Design | 1998 | 109 |
5 | Spectral Moments of the Edge Adjacency Matrix in Molecular Graphs. 3. Molecules Containing Cycles | Journal of Chemical Information and Computer Sciences | 1998 | 108 |
6 | Polarizability and optical rotation calculated from the approximate coupled cluster singles and doubles CC2 linear response theory using Cholesky decompositions | Journal of Chemical Physics | 2004 | 107 |
7 | Biopolymer coating of soybean lecithin liposomes via layer-by-layer self-assembly as novel delivery system for ellagic acid | Journal of Functional Foods | 2010 | 98 |
8 | Molecular surface area and hydrophobic effect | Protein Engineering, Design and Selection | 1992 | 85 |
9 | Artificial Neural Networks and Linear Discriminant Analysis: A Valuable Combination in the Selection of New Antibacterial Compounds | Journal of Chemical Information and Computer Sciences | 2004 | 69 |
10 | Highly activated screen-printed carbon electrodes by electrochemical treatment with hydrogen peroxide | Electrochemistry Communications | 2018 | 65 |
11 | Naphthalenediimide Polymers with Finely Tuned In‐Chain π‐Conjugation: Electronic Structure, Film Microstructure, and Charge Transport Properties | Advanced Materials | 2016 | 63 |
12 | Topological Approach to Analgesia | Journal of Chemical Information and Computer Sciences | 1994 | 60 |
13 | Surfactant-Mediated Morphology and Photocatalytic Activity of α-Ag2WO4 Material | Journal of Physical Chemistry C | 2018 | 60 |
14 | Discrimination and selection of new potential antibacterial compounds using simple topological descriptors | Journal of Molecular Graphics and Modelling | 2003 | 54 |
15 | Vis/NIR spectroelectrochemical analysis of poly-(Azure A) on ITO electrode | Electrochemistry Communications | 2006 | 51 |
16 | AM1 prediction of the equilibrium geometry of Si60 | Chemical Physics Letters | 1993 | 50 |
17 | Evidence of Wallerian degeneration in normal appearing white matter in the early stages of relapsing-remitting multiple sclerosis | Journal of Neurology | 2003 | 48 |
18 | Rovibrational structure of the Ar–CO complex based on a novel three-dimensional ab initio potential | Journal of Chemical Physics | 2002 | 47 |
19 | Determination of metabolite concentrations in human brain tumour biopsy samples using HR‐MAS and ERETIC measurements | NMR in Biomedicine | 2009 | 47 |
20 | On a topological interpretation of electronic and vibrational molecular energies | Computational and Theoretical Chemistry | 1998 | 44 |
21 | Topological virtual screening: a way to find new compounds active in ulcerative colitis by inhibiting NF-κB | Molecular Diversity | 2011 | 44 |
22 | Experimental and theoretical study to explain the morphology of CaMoO 4 crystals | Journal of Physics and Chemistry of Solids | 2018 | 42 |
23 | Theoretical approach for determining the relation between the morphology and surface magnetism of Co3O4 | Journal of Magnetism and Magnetic Materials | 2018 | 42 |
24 | Electrochemical performance of activated screen printed carbon electrodes for hydrogen peroxide and phenol derivatives sensing | Journal of Electroanalytical Chemistry | 2019 | 41 |
25 | Artificial neural network applied to the discrimination of antibacterial activity by topological methods | Computational and Theoretical Chemistry | 2000 | 40 |
26 | A novel ultradeformable liposomes of Naringin for anti-inflammatory therapy | Colloids and Surfaces B: Biointerfaces | 2018 | 40 |
27 | Nanoliposomes in Cancer Therapy: Marketed Products and Current Clinical Trials | International Journal of Molecular Sciences | 2022 | 37 |
28 | Use of topological descriptiors in chromatographic chiral separations | Journal of Chromatography A | 1996 | 36 |
29 | Artificial Neural Network Applied to Prediction of Fluorquinolone Antibacterial Activity by Topological Methods | Journal of Medicinal Chemistry | 2000 | 35 |
30 | Mangiferin nanoemulsions in treatment of inflammatory disorders and skin regeneration | International Journal of Pharmaceutics | 2019 | 33 |
31 | Drugs and Nondrugs: An Effective Discrimination with Topological Methods and Artificial Neural Networks | Journal of Chemical Information and Computer Sciences | 2003 | 32 |
32 | Contribution to the study of the alteration of lipase activity ofCandida rugosa by ions and buffers | Applied Biochemistry and Biotechnology | 1994 | 31 |
33 | Innovative Combination of Three Alternating Current Relaxation Techniques: Electrical Charge, Mass, and Color Impedance Spectroscopy. Part II: Prussian Blue ⇆ Everitt’s Salt Process | Journal of Physical Chemistry C | 2009 | 31 |
34 | Convergence of Theory and Experiment on the Role of Preorganization, Quantum Tunneling, and Enzyme Motions into Flavoenzyme-Catalyzed Hydride Transfer | ACS Catalysis | 2017 | 31 |
35 | Cyclic voltammetric generation and electrochemical quartz crystal microbalance characterization of passive layer of nickel in a weakly acid medium | Journal of Solid State Electrochemistry | 2005 | 28 |
36 | Kinetic calculations of the Ni anodic dissolution from EIS | Journal of Solid State Electrochemistry | 2005 | 27 |
37 | QSAR Multi-Target in Drug Discovery: A Review | Current Computer-Aided Drug Design | 2014 | 27 |
38 | Prediction and Interpretation of Some Pharmacological Properties of Cephalosporins Using Molecular Connectivity | Drug Investigation | 1991 | 26 |
39 | Spectroscopic metabolomic abnormalities in the thalamus related to auditory hallucinations in patients with schizophrenia | Schizophrenia Research | 2008 | 26 |
40 | Prediction of chromatographic properties for a group of natural phenolic derivatives by molecular topology | Journal of Chromatography A | 1996 | 25 |
41 | Loss of heterozygosity at 1p-19q induces a global change in oligodendroglial tumor gene expression | Journal of Neuro-Oncology | 2009 | 25 |
42 | Discovery of New Antimalarial Compounds by use of Molecular Connectivity Techniques | Journal of Pharmacy and Pharmacology | 2010 | 25 |
43 | Innovative Combination of Three Alternating Current Relaxation Techniques: Electrical Charge, Mass, and Color Impedance Spectroscopy. Part I: The Tool | Journal of Physical Chemistry C | 2009 | 24 |
44 | Experimental and theoretical study of the energetic, morphological, and photoluminescence properties of CaZrO3:Eu3+ | CrystEngComm | 2018 | 22 |
45 | Formation of Ag nanoparticles under electron beam irradiation: Atomistic origins from first‐principles calculations | International Journal of Quantum Chemistry | 2018 | 21 |
46 | Novel potential agents for ulcerative colitis by molecular topology: suppression of IL-6 production in Caco-2 and RAW 264.7 cell lines | Molecular Diversity | 2013 | 20 |
47 | Electrochemical behaviour and electrical percolation in graphite-epoxy electrodes | Journal of Materials Science | 1994 | 19 |
48 | Electrochemical reduction of the nitrite to ammonium ions in presence of [MoO2(O2CC(S)C6H5)2]2− | Electrochimica Acta | 1995 | 19 |
49 | A novel lidocaine hydrochloride mucoadhesive films for periodontal diseases | Journal of Materials Science: Materials in Medicine | 2019 | 19 |
50 | Calculation of the rate constants of nickel electrodissolution in acid medium from EIS | Journal of Solid State Electrochemistry | 2006 | 18 |