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Topological Symmetry Transition between Toroidal and Klein Bottle Graphenic Systems †.
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- Symmetry (20738994), 2020, v. 12, n. 8, p. 1233, doi. 10.3390/sym12081233
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- Article
Protein Interaction with Dendrimer Monolayers: Energy and Surface Topology.
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- Symmetry (20738994), 2020, v. 12, n. 4, p. 641, doi. 10.3390/sym12040641
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- Publication type:
- Article
Three-Body Excitations in Fock-Space Coupled-Cluster: Fourth Order Perturbation Correction to Electron Affinity and Its Relation to Bondonic Formalism.
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- International Journal of Molecular Sciences, 2021, v. 22, n. 16, p. 8953, doi. 10.3390/ijms22168953
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- Article
Solvent-Induced Formation of Novel Ni(II) Complexes Derived from Bis-Thiosemicarbazone Ligand: An Insight from Experimental and Theoretical Investigations.
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- International Journal of Molecular Sciences, 2021, v. 22, n. 10, p. 5337, doi. 10.3390/ijms22105337
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- Article
Energy-Dependent Endocytosis Is Responsible for Skin Penetration of Formulations Based on a Combination of Indomethacin Nanoparticles and l-Menthol in Rat and Göttingen Minipig.
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- International Journal of Molecular Sciences, 2021, v. 22, n. 10, p. 5137, doi. 10.3390/ijms22105137
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- Article
The Effects of Random Porosities in Resonant Frequencies of Graphene Based on the Monte Carlo Stochastic Finite Element Model.
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- International Journal of Molecular Sciences, 2021, v. 22, n. 9, p. 4814, doi. 10.3390/ijms22094814
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- Article
Ex Vivo and In Vivo Analyses of Novel 3D-Printed Bone Substitute Scaffolds Incorporating Biphasic Calcium Phosphate Granules for Bone Regeneration.
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- International Journal of Molecular Sciences, 2021, v. 22, n. 7, p. 3588, doi. 10.3390/ijms22073588
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- Article
Hepatitis B Virus-Like Particle: Targeted Delivery of Plasmid Expressing Short Hairpin RNA for Silencing the Bcl-2 Gene in Cervical Cancer Cells.
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- International Journal of Molecular Sciences, 2021, v. 22, n. 5, p. 2320, doi. 10.3390/ijms22052320
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- Article
Adsorption Studies of Volatile Organic Compound (Naphthalene) from Aqueous Effluents: Chemical Activation Process Using Weak Lewis Acid, Equilibrium Kinetics and Isotherm Modelling.
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- International Journal of Molecular Sciences, 2021, v. 22, n. 4, p. 2090, doi. 10.3390/ijms22042090
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- Article
Environmentally Friendly Polymer Compositions with Natural Amber Acid.
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- International Journal of Molecular Sciences, 2021, v. 22, n. 4, p. 1556, doi. 10.3390/ijms22041556
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- Article
Chemical Bonding by the Chemical Orthogonal Space of Reactivity.
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- International Journal of Molecular Sciences, 2021, v. 22, n. 1, p. 223, doi. 10.3390/ijms22010223
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- Article
Fock-Space Coupled Cluster Theory: Systematic Study of Partial Fourth Order Triples Schemes for Ionization Potential and Comparison with Bondonic Formalism.
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- International Journal of Molecular Sciences, 2020, v. 21, n. 17, p. 6199, doi. 10.3390/ijms21176199
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- Article
Atoms in Generalized Orbital Configurations: Towards Atom-Dedicated Density Functionals.
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- International Journal of Molecular Sciences, 2019, v. 20, n. 23, p. 5943, doi. 10.3390/ijms20235943
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- Article
Ligand Shaping in Induced Fit Docking of MraY Inhibitors. Polynomial Discriminant and Laplacian Operator as Biological Activity Descriptors.
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- International Journal of Molecular Sciences, 2017, v. 18, n. 7, p. 1377, doi. 10.3390/ijms18071377
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- Article
Molecular Dynamic Studies of the Complex Polyethylenimine and Glucose Oxidase.
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- International Journal of Molecular Sciences, 2016, v. 17, n. 11, p. 1796, doi. 10.3390/ijms17111796
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- Article
Learning the Relationship between the Primary Structure of HIV Envelope Glycoproteins and Neutralization Activity of Particular Antibodies by Using Artificial Neural Networks.
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- International Journal of Molecular Sciences, 2016, v. 17, n. 10, p. 1710, doi. 10.3390/ijms17101710
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- Article
Chemical Structure-Biological Activity Models for Pharmacophores' 3D-Interactions.
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- International Journal of Molecular Sciences, 2016, v. 17, n. 7, p. 1087, doi. 10.3390/ijms17071087
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- Article
Linear and Branched PEIs (Polyethylenimines) and Their Property Space.
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- International Journal of Molecular Sciences, 2016, v. 17, n. 4, p. 555, doi. 10.3390/ijms17040555
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- Article
Double Variational Binding--(SMILES) Conformational Analysis by Docking Mechanisms for Anti-HIV Pyrimidine Ligands.
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- International Journal of Molecular Sciences, 2015, v. 16, n. 8, p. 19553, doi. 10.3390/ijms160819553
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- Article
Structure-Biological Function Relationship Extended to Mitotic Arrest-Deficient 2-Like Protein Mad2 Native and Mutants-New Opportunity for Genetic Disorder Control.
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- International Journal of Molecular Sciences, 2014, v. 15, n. 11, p. 21381, doi. 10.3390/ijms151121381
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- Article
Spectral Inverse Quantum (Spectral-IQ) Method for Modeling Mesoporous Systems: Application on Silica Films by FTIR.
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- International Journal of Molecular Sciences, 2012, v. 13, n. 12, p. 15925, doi. 10.3390/ijms131215925
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- Publication type:
- Article
Introducing Catastrophe-QSAR. Application on Modeling Molecular Mechanisms of Pyridinone Derivative-Type HIV Non-Nucleoside Reverse Transcriptase Inhibitors.
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- International Journal of Molecular Sciences, 2011, v. 12, n. 12, p. 9533, doi. 10.3390/ijms12129533
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- Article
Topological Anisotropy of Stone-Wales Waves in Graphenic Fragments.
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- International Journal of Molecular Sciences, 2011, v. 12, n. 11, p. 7934, doi. 10.3390/ijms12117934
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- Article
Alert-QSAR. Implications for Electrophilic Theory of Chemical Carcinogenesis.
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- International Journal of Molecular Sciences, 2011, v. 12, n. 8, p. 5098, doi. 10.3390/ijms12085098
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- Article
The Bondons: The Quantum Particles of the Chemical Bond.
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- International Journal of Molecular Sciences, 2010, v. 11, n. 11, p. 4227, doi. 10.3390/ijms11114227
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- Article
On Heisenberg Uncertainty Relationship, Its Extension, and the Quantum Issue of Wave-Particle Duality.
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- International Journal of Molecular Sciences, 2010, v. 11, n. 10, p. 4124, doi. 10.3390/ijms11104124
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- Article
Compactness Aromaticity of Atoms in Molecules.
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- International Journal of Molecular Sciences, 2010, v. 11, n. 4, p. 1269, doi. 10.3390/ijms11041269
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- Article
Path Integrals for Electronic Densities, Reactivity Indices, and Localization Functions in Quantum Systems.
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- International Journal of Molecular Sciences, 2009, v. 10, n. 11, p. 4816, doi. 10.3390/ijms10114816
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- Article
Köln-Timişoara Molecular Activity Combined Models toward Interspecies Toxicity Assessment.
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- International Journal of Molecular Sciences, 2009, v. 10, n. 10, p. 4474, doi. 10.3390/ijms10104474
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- Article
Effect of the Polysaccharide Extract from the Edible Mushroom Pleurotus ostreatus against Infectious Bursal Disease Virus.
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- International Journal of Molecular Sciences, 2009, v. 10, n. 8, p. 3616, doi. 10.3390/ijms10083616
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- Article
Quantum-SAR Extension of the Spectral-SAR Algorithm, Application to Polyphenolic Anticancer Bioactivity.
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- International Journal of Molecular Sciences, 2009, v. 10, n. 3, p. 1193, doi. 10.3390/ijms10031193
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- Article
Noble gas endohedral fullerenes, Ng@C60 (Ng=Ar, Kr): a particular benchmark for assessing the account of non-covalent interactions by density functional theory calculations.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2016, v. 135, n. 5, p. 1, doi. 10.1007/s00214-016-1883-z
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- Article
About the Mulliken electronegativity in DFT.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2005, v. 114, n. 1-3, p. 38, doi. 10.1007/s00214-005-0641-4
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- Article
THE PRESENT FUTURE OF THE GRAPHENIC SEMICONDUCTOR.
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- New Frontiers in Chemistry, 2018, v. 27, n. 1, p. 28
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- Article
TOPO-CHEMICAL REACTIVITY STUDY ON MOLECULAR MACHINES.
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- New Frontiers in Chemistry, 2020, v. 29, n. 2, p. 69
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- Article
MATRICEAL HETEROJUNCTIONS ON GRAPHENE. FIRST METROLOGICAL MEASUREMENTS.
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- New Frontiers in Chemistry, 2020, v. 29, n. 1, p. 33
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- Article
CHARACTERIZATION OF BENZENE AND CORONENE MOLECULES AS SUBSYSTEMS OF A GRAPHENE NANORIBBON IN DIFFERENT BONDING STATES.
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- New Frontiers in Chemistry, 2020, v. 29, n. 1, p. 21
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- Article
"WEAPON OF MASS DESTRUCTION" (WMD) ISSUE: THE TIMISOARA CASE - NOVEMBER 2019.
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- New Frontiers in Chemistry, 2019, v. 28, n. 2, p. 114
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- Article
NATIONAL CONFERENCE OF DOCTORAL SCHOOLS FROM THE UNIVERSITY CONSORTIUM - CHEMISTRY SECTION, WEST UNIVERSITY OF TIMISOARA, 11-14 NOVEMBER 2019.
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- 2019
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- Publication type:
- Proceeding
NANOMOD (22-23 APRIL), TIMISOARA.
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- New Frontiers in Chemistry, 2019, v. 28, n. 2, p. 110
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- Article
CHEMICAL REACTIVITY DRIVING SWITCHABLE MOLECULAR MACHINES.
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- New Frontiers in Chemistry, 2019, v. 28, n. 1, p. 54
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- Article
GREEN'S FUNCTION IN MODELING GRAPHENIC CHEMICAL BONDS.
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- New Frontiers in Chemistry, 2019, v. 28, n. 1, p. 58
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- Article
OPTIMIZING DEVICE OF LOGICAL MATRICES TOWARDS SEMICONDUCTIVITY.
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- New Frontiers in Chemistry, 2019, v. 28, n. 1, p. 51
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- Article
THE INFLUENCE OF ORGANIC STABILIZATORS IN THE WATER SPLITTING PROCESS USING SEMICONDUCTOR PHOTOCATALYSTS.
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- New Frontiers in Chemistry, 2019, v. 28, n. 1, p. 49
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- Article
ORBITAL CLUSTERING METHOD FOR KNOWLEDGE MANAGEMENT OF INNOVATIONS.
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- New Frontiers in Chemistry, 2019, v. 28, n. 1, p. 18
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- Article
TOPOLOGICAL SIMILARITIES TORI AND KLEIN BOTTLE NANOSTRUCTURES.
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- New Frontiers in Chemistry, 2019, v. 28, n. 1, p. 11
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- Article
TOPOLOGICAL EVOLUTION OF THE 5|8|5 DEFECT IN GRAPHENE.
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- New Frontiers in Chemistry, 2018, v. 27, n. 2, p. 105
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- Article
ELECTROCHEMICAL SYSTEMS AND MECHANICALLY INTERLOCKED MOLECULES. PART 2: NANOTECHNOLOGY.
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- New Frontiers in Chemistry, 2018, v. 27, n. 2, p. 89
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- Article
ELECTROCHEMICAL SYSTEMS AND MECHANICALLY INTERLOCKED MOLECULES. PART 1: NANOSCIENCE.
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- New Frontiers in Chemistry, 2018, v. 27, n. 2, p. 73
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- Article
ORTHOGONAL PHOTOCHEMISTRYELECTROCHEMISTRY WITH MOLECULAR MACHINES.
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- New Frontiers in Chemistry, 2018, v. 27, n. 1, p. 48
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- Publication type:
- Article