Pregled po CROSBI profilu: Robert Vianello (CROSBI Profil: 29113, MBZ: 237604, ORCID: 0000-0003-1779-4524)
Pronađeno 285 radova
Prikaz po CROSBI kategorijama
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1.The 5th Central European Conference - Chemistry towards Biology / Abramić, Marija ; Maksić, Zvonimir ; Salopek-Sondi, Branka ; Tomić, Sanja ; Robert Vianello (ur.). Zagreb: Institut Ruđer Bošković, 2010 (zbornik)
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1.Optical Sensing (Nano)Materials Based on Benzimidazole Derivatives // Chemistry and Applications of Benzimidazole and its Derivatives / Marinescu, Maria (ur.).
London : Delhi: IntechOpen, 2019. str. 184-205 doi:10.5772/intechopen.85643 -
2.EVB simulation of the catalytic activity of monoamine oxidases: from chemical physics to neurodegeneration // Theory and applications of the empirical valence bond approach: from physical chemistry to chemical biology / Duarte, Fernanda ; Kamerlin, Shina Caroline Lynn (ur.).
Chichester: John Wiley & Sons, 2017. str. 199-231 doi:10.1002/9781119245544.ch8 -
1.Utilization of a kinetic isotope effect to decrease decomposition of ceftriaxone in a mixture of D2O/H2O // European journal of pharmaceutical sciences, 187 (2023), 106461, 18 doi:10.1016/j.ejps.2023.106461 (međunarodna recenzija, članak, znanstveni)
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2.Selective Deuteration Improves the Affinity of Adenosine A2A Receptor Ligands: A Computational Case Study with Istradefylline and Caffeine // Journal of chemical information and modeling, 63 (2023), 10; 3138-3149 doi:10.1021/acs.jcim.3c00424 (međunarodna recenzija, članak, znanstveni)
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3.Biological evaluation of novel amidino substituted coumarin-benzazole hybrids as promising therapeutic agents // RSC Medicinal Chemistry, 14 (2023), 957-968 doi:10.1039/D3MD00055A (međunarodna recenzija, članak, znanstveni)
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4.Phenanthridine–pyrene conjugates as fluorescent probes for DNA/RNA and an inactive mutant of dipeptidyl peptidase enzyme // Beilstein journal of organic chemistry, 19 (2023), 550-565 doi:10.3762/bjoc.19.40 (međunarodna recenzija, članak, znanstveni)
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5.Farmaceutski značaj procesa stereoizomerizacije // Kemija u industriji : časopis kemičara i tehnologa Hrvatske, (2023), 1-2; 55-64 doi:10.15255/kui.2022.027 (domaća recenzija, pregledni rad, stručni)
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6.An expedient metal-free cascade route to chromonyl diene scaffolds: thermodynamic vs. kinetic control // RSC Advances, 12 (2022), 54; 34946-34950 doi:10.1039/d2ra05704b (međunarodna recenzija, članak, znanstveni)
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7.Potentiometric Surfactant Sensor for Anionic Surfactants Based on 1,3-dioctadecyl-1H-imidazol- 3-ium tetraphenylborate // Chemosensors, 10 (2022), 12; 523, 14 doi:10.3390/chemosensors10120523 (međunarodna recenzija, članak, znanstveni)
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8.Tuning the coordination properties of chiral pseudopeptide bis(2-picolyl)amine and iminodiacetamide ligands in Zn(II) and Cu(II) complexes // Dalton transactions, 51 (2022), 44; 17008-17021 doi:10.1039/d2dt02895f (međunarodna recenzija, članak, znanstveni)
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9.Deep eutectic solvents as a stabilising medium for NAD coenzyme: unravelling the mechanism behind coenzyme stabilisation effect // Green chemistry, 24 (2022), 19; 7661-7674 doi:10.1039/d2gc02656b (međunarodna recenzija, članak, znanstveni)
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10.A series of nickel(II) thiocyanate complexes comprising various molar contents of isonicotinamide and water as ligands or co- crystallized moieties – an experimental and computational study // CrystEngComm, 24 (2022), 37; 6564-6578 doi:10.1039/d2ce00847e (međunarodna recenzija, članak, znanstveni)
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11.Expanding the scope of enantioselective halohydrin dehalogenases – group B // Advanced synthesis & catalysis, 364 (2022), 15; 2576-2588 doi:10.1002/adsc.202200342 (međunarodna recenzija, članak, znanstveni)
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12.Imidazo[4,5-b]pyridine derived tubulin polymerization inhibitors: Design, synthesis, biological activity in vitro and computational analysis // Bioorganic chemistry, 127 (2022), 106032, 13 doi:10.1016/j.bioorg.2022.106032 (međunarodna recenzija, članak, znanstveni)
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13.Design and synthesis of harmiquins, harmine and chloroquine hybrids as potent antiplasmodial agents // European journal of medicinal chemistry, 238 (2022), 114408, 15 doi:10.1016/j.ejmech.2022.114408 (međunarodna recenzija, članak, znanstveni)
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14.An experimental and computational study of new spiro-barbituric acid pyrazoline scaffolds: restricted rotation vs. annular tautomerism // New journal of chemistry, 46 (2022), 15; 7242-7252 doi:10.1039/d1nj06208e (međunarodna recenzija, članak, znanstveni)
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15.Imidazo[4,5-b]pyridine derived iminocoumarins as potential pH probes: Synthesis, spectroscopic and computational studies of their protonation equilibria // Journal of molecular liquids, 355 (2022), 118982, 12 doi:10.1016/j.molliq.2022.118982 (međunarodna recenzija, članak, znanstveni)
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16.COVID-19 infection and neurodegeneration: Computational evidence for interactions between the SARS-CoV-2 spike protein and monoamine oxidase enzymes // Computational and Structural Biotechnology Journal, 20 (2022), 1254-1263 doi:10.1016/j.csbj.2022.02.020 (međunarodna recenzija, članak, znanstveni)
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17.Why monoamine oxidase B preferably metabolizes N-methylhistamine over histamine: evidence from the multiscale simulation of the rate-limiting step // International journal of molecular sciences, 23 (2022), 3; 1910, 15 doi:10.3390/ijms23031910 (međunarodna recenzija, članak, znanstveni)
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18.Proton affinity and gas phase basicity of diamandoid molecules: diamantane to C131H116 // PCCP. Physical chemistry chemical physics, 24 (2022), 3470-3477 doi:10.1039/d1cp04177k (međunarodna recenzija, članak, znanstveni)
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19.Spectroscopic and computational study of the protonation equilibria of amino-substituted benzo[b]thieno[2,3-b]pyrido[1,2-a]benzimidazoles as novel pH-sensing materials // Chemosensors, 10 (2022), 1; 21, 15 doi:10.3390/chemosensors10010021 (međunarodna recenzija, članak, znanstveni)
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20.Chemistry of Spontaneous Alkylation of Methimazole with 1,2-Dichloroethane // Molecules, 26 (2021), 22; 7032, 21 doi:10.3390/molecules26227032 (međunarodna recenzija, članak, znanstveni)
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21.Synthesis, computational analysis, and antiproliferative activity of novel benzimidazole acrylonitriles as tubulin polymerization inhibitors: Part 2 // Pharmaceuticals, 14 (2021), 10; 1052, 26 doi:10.3390/ph14101052 (međunarodna recenzija, članak, znanstveni)
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22.Novel imidazo[4,5-b]pyridine derived acrylonitriles: A combined experimental and computational study of their antioxidative potential // Journal of molecular liquids, 342 (2021), 117527, 14 doi:10.1016/j.molliq.2021.117527 (međunarodna recenzija, članak, znanstveni)
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23.Further investigation of harmicines as novel antiplasmodial agents: synthesis, structure-activity relationship and insight into the mechanism of action // European journal of medicinal chemistry, 224 (2021), 113687, 20 doi:10.1016/j.ejmech.2021.113687 (međunarodna recenzija, članak, znanstveni)
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24.Potentiometric surfactant sensor based on 1,3-dihexadecyl-1H-benzo[d]imidazol-3-ium for anionic surfactants in detergents and household care products // Molecules, 26 (2021), 12; 3627, 14 doi:10.3390/molecules26123627 (međunarodna recenzija, članak, znanstveni)
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25.Novel bis- and mono-pyrrolo[2,3-d]pyrimidine and purine derivatives: Synthesis, computational analysis and antiproliferative evaluation // Molecules, 26 (2021), 11; 3334, 26 doi:10.3390/molecules26113334 (međunarodna recenzija, članak, znanstveni)
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26.6-Morpholino- and 6-amino-9-sulfonylpurine derivatives. Synthesis, computational analysis, and biological activity // Nucleosides, nucleotides & nucleic acids, 40 (2021), 4; 470-503 doi:10.1080/15257770.2021.1896001 (međunarodna recenzija, članak, znanstveni)
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27.Self‐assembly of cobalt(II) coordination polymers with differently halosubstituted nicotinate ligands and 4,4’‐bipyridine – the effect of the halosubstituent positions on polymer types // European journal of inorganic chemistry, 2021 (2021), 15; 1470-1480 doi:10.1002/ejic.202100055 (međunarodna recenzija, članak, znanstveni)
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28.Amidino substituted 2-aminophenols: biologically important building blocks for the amidino- functionalization of 2-substituted benzoxazoles // Organic & biomolecular chemistry, 19 (2021), 2784-2793 doi:10.1039/d1ob00235j (međunarodna recenzija, članak, znanstveni)
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29.Direct Metal-Free Transformation of Alkynes to Nitriles: Computational Evidence for the Precise Reaction Mechanism // International journal of molecular sciences, 22 (2021), 6; 3193, 16 doi:10.3390/ijms22063193 (međunarodna recenzija, članak, znanstveni)
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30.N-substituted benzimidazole acrylonitriles as in vitro tubulin polymerization inhibitors: Synthesis, biological activity and computational analysis // European journal of medicinal chemistry, 211 (2021), 113003, 14 doi:10.1016/j.ejmech.2020.113003 (međunarodna recenzija, članak, znanstveni)
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31.How monoamine oxidase a decomposes serotonin: an empirical valence bond simulation of the reactive step // The journal of physical chemistry. B, Condensed matter, materials, surfaces, interfaces & biophysical, 124 (2020), 38; 8259-8265 doi:10.1021/acs.jpcb.0c06502 (međunarodna recenzija, članak, znanstveni)
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32.The Effect of Deuteration on the H2 Receptor Histamine Binding Profile: A Computational Insight into Modified Hydrogen Bonding Interactions // Molecules, 25 (2020), 24; 6017, 17 doi:10.3390/molecules25246017 (međunarodna recenzija, članak, znanstveni)
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33.Synthesis and Basicity Studies of Quinolino[7,8‑h]quinoline Derivatives // Journal of organic chemistry, 85 (2020), 11297-11308 doi:10.1021/acs.joc.0c01428 (međunarodna recenzija, članak, znanstveni)
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34.The role of non-covalent intermolecular interactions on the diversity of crystal packing in supramolecular dihalopyridine–silver(I) nitrate complexes // Crystengcomm, 22 (2020), 7962-7974 doi:10.1039/d0ce01257b (međunarodna recenzija, članak, znanstveni)
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35.Novel Harmicines with Improved Potency against Plasmodium // Molecules, 25 (2020), 19; 4376, 19 doi:10.3390/molecules25194376 (međunarodna recenzija, članak, znanstveni)
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36.Hydride Abstraction as the Rate-Limiting Step of the Irreversible Inhibition of Monoamine Oxidase B by Rasagiline and Selegiline: A Computational Empirical Valence Bond Study // International journal of molecular sciences, 21 (2020), 17; 6151, 13 doi:10.3390/ijms21176151 (međunarodna recenzija, članak, znanstveni)
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37.Indomethacin increases quercetin affinity for human serum albumin: a combined experimental and computational study and its broader implications // International journal of molecular sciences, 21 (2020), 16; 5740, 14 doi:10.3390/ijms21165740 (međunarodna recenzija, članak, znanstveni)
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38.Copper(II) and zinc(II) complexes of mono- and bis-1,2,3-triazole substituted heterocyclic ligands // Dalton transactions, 49 (2020), 26; 9002-9015 doi:10.1039/d0dt01244k (međunarodna recenzija, članak, znanstveni)
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39.Novel insights into the thioesterolytic activity of N-substituted pyridinium-4-oximes // Molecules, 25 (2020), 10; 2385, 16 doi:10.3390/molecules25102385 (međunarodna recenzija, članak, znanstveni)
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40.Is It Possible to Achieve Organic Superbases beyond the Basicity Limit Using Tetrahedrane Scaffolds? // ChemistrySelect, 5 (2020), 19; 5794-5798 doi:10.1002/slct.202001407 (međunarodna recenzija, članak, znanstveni)
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41.How Important Is the Use of Cocaine and Amphetamines in the Development of Parkinson Disease? A Computational Study // Neurotoxicity research, 37 (2020), 724-731 doi:10.1007/s12640-019-00149-0 (međunarodna recenzija, članak, znanstveni)
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42.Structural variety of isopropyl-bis(2- picolyl)amine complexes with zinc(II) and copper(II) // Crystal growth & design, 20 (2020), 4; 2440-2453 doi:10.1021/acs.cgd.9b01625 (međunarodna recenzija, članak, znanstveni)
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43.Relevance of Hydrogen Bonds for the Histamine H2 Receptor-Ligand Interactions: A Lesson from Deuteration // Biomolecules, 10 (2020), 2; 196, 10 doi:10.3390/biom10020196 (međunarodna recenzija, članak, znanstveni)
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44.Harmicines − harmine and cinnamic acid hybrids as novel antiplasmodial hits // European journal of medicinal chemistry, 187 (2020), 111927, 16 doi:10.1016/j.ejmech.2019.111927 (međunarodna recenzija, članak, znanstveni)
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45.Photophysical properties and immobilisation of fluorescent pH responsive aminated benzimidazo[1,2-a]quinoline-6-carbonitriles // Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 227 (2020), 117588, 15 doi:10.1016/j.saa.2019.117588 (međunarodna recenzija, članak, znanstveni)
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46.Stereochemistry of Hexacoordinated Zn(II), Cu(II), Ni(II), and Co(II) Complexes with Iminodiacetamide Ligands // Inorganic chemistry, 58 (2019), 24; 16445-16457 doi:10.1021/acs.inorgchem.9b02200 (međunarodna recenzija, članak, znanstveni)
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47.From Hydrogen Peroxide-Responsive Boronated Nucleosides Towards Antisense Therapeutics – A Computational Mechanistic Study // Croatica chemica acta, 92 (2019), 2; 287-295 doi:10.5562/cca3592 (međunarodna recenzija, članak, znanstveni)
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48.A density functional theory study on the superacidity of sulfuric, fluorosulfuric, and triflic acid derivatives with two cyclopentadiene rings: ion pairs formation in the gas phase // Journal of physical organic chemistry, 32 (2019), 10; e3995, 10 doi:10.1002/poc.3995 (međunarodna recenzija, članak, znanstveni)
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49.On the Basicity of Organic Bases in Different Media // European journal of organic chemistry, 2019 (2019), 40; 6735-6748 doi:10.1002/ejoc.201900956 (međunarodna recenzija, pregledni rad, znanstveni)
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50.Experimental and computational study of the antioxidative potential of novel nitro and amino substituted benzimidazole/benzothiazole-2-carboxamides with antiproliferative activity // Antioxidants, 8 (2019), 10; 477, 22 doi:10.3390/antiox8100477 (međunarodna recenzija, članak, znanstveni)
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51.Transacylation in Ferrocenoyl-Purines. NMR and Computational Study of the Isomerization Mechanism // Journal of organic chemistry, 84 (2019), 19; 12471-12480 doi:10.1021/acs.joc.9b01944 (međunarodna recenzija, članak, znanstveni)
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52.Computational Insight into the Mechanism of the Irreversible Inhibition of Monoamine Oxidase Enzymes by the Antiparkinsonian Propargylamine Inhibitors Rasagiline and Selegiline // ACS Chemical Neuroscience, 10 (2019), 8; 3532-3542 doi:10.1021/acschemneuro.9b00147 (međunarodna recenzija, članak, znanstveni)
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53.DNA/RNA recognition controlled by the glycine linker and the guanidine moiety of phenanthridine peptides // International journal of biological macromolecules, 134 (2019), 422-434 doi:10.1016/j.ijbiomac.2019.05.063 (međunarodna recenzija, članak, znanstveni)
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54.Tuneable solid-state emitters based on benzimidazole derivatives: aggregation induced red emission and mechanochromism of D-π-A fluorophores // Dyes and pigments, 162 (2019), 688-696 doi:10.1016/j.dyepig.2018.10.069 (međunarodna recenzija, članak, znanstveni)
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55.Superacidity of -P(OH)3 and -SO(OH)2 derivatives of cyclopentadiene and vinylcyclopentadiene in the gas phase: A computational DFT analysis // International journal of quantum chemistry, 118 (2018), 21; e25754, 10 doi:10.1002/qua.25754 (međunarodna recenzija, članak, znanstveni)
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56.Supramolecular inter-ionic charge-transfer complexes between derivatives of pyridinium-4-oxime cations and hexacyanoferrate(II) anions // New journal of chemistry, 42 (2018), 16115-16126 doi:10.1039/c8nj03066a (međunarodna recenzija, članak, znanstveni)
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57.Amino-substituted benzamide derivatives as promising antioxidant agents: a combined experimental and computational study // Chemical research in toxicology, 31 (2018), 9; 974-984 doi:10.1021/acs.chemrestox.8b00175 (međunarodna recenzija, članak, znanstveni)
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58.Empirical Valence Bond Simulations Suggest a Direct Hydride Transfer Mechanism for Human Diamine Oxidase // ACS Omega, 3 (2018), 4; 3665-3674 doi:10.1021/acsomega.8b00346 (međunarodna recenzija, članak, znanstveni)
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59.Design of Exceptionally Strong Organic Superbases Based on Aromatic Pnictogen Oxides: Computational DFT Analysis of the Oxygen Basicity in the Gas Phase and Acetonitrile Solution // The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 122 (2018), 5; 1464-1471 doi:10.1021/acs.jpca.7b11945 (međunarodna recenzija, članak, znanstveni)
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60.The Metal effect on self-assembling of oxalamide gelators explored by mass spectrometry and DFT calculations // Journal of the American Society for Mass Spectrometry, 28 (2018), 1; 103-113 doi:10.1007/s13361-017-1834-5 (međunarodna recenzija, članak, znanstveni)
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61.Colourimetric and fluorimetric metal ion chemosensor based on a benzimidazole functionalised Schiff base // Supramolecular chemistry, 30 (2018), 10; 891-900 doi:10.1080/10610278.2018.1436708 (podatak o recenziji nije dostupan, članak, znanstveni)
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62.Fluorescent benzimidazo[1,2-a]quinolines: synthesis, spectroscopic and computational studies of protonation equilibria and metal ion sensitivity // New journal of chemistry, 41 (2017), 1; 358-371 doi:10.1039/c6nj02268e (međunarodna recenzija, članak, znanstveni)
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63.Multiscale simulation of monoamine oxidase catalyzed decomposition of phenylethylamine analogs // European journal of pharmacology, 817 (2017), 46-50 doi:10.1016/j.ejphar.2017.05.061 (međunarodna recenzija, članak, znanstveni)
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64.Nucleobase–Guanidiniocarbonyl-Pyrrole Conjugates as Novel Fluorimetric Sensors for Single Stranded RNA // Molecules, 22 (2017), 12; 2213, 22 doi:10.3390/molecules22122213 (međunarodna recenzija, članak, znanstveni)
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65.Elementary SN2 reaction revisited. Effects of solvent and alkyl chain length on kinetics of halogen exchange in haloalkanes elucidated by Empirical Valence Bond simulation // Computational and Theoretical Chemistry, 1116 (2017), 96-101 doi:10.1016/j.comptc.2017.02.003 (međunarodna recenzija, članak, znanstveni)
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66.On the Basicity of Conjugated Nitrogen Heterocycles in Different Media // European journal of organic chemistry, 2017 (2017), 30; 4475-4489 doi:10.1002/ejoc.201700749 (međunarodna recenzija, članak, znanstveni)
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67.Catalytic Dyad in the SGNH Hydrolase Superfamily: In-depth Insight into Structural Parameters Tuning the Catalytic Process of Extracellular Lipase from Streptomyces rimosus // Acs chemical biology, 12 (2017), 7; 1928-1936 doi:10.1021/acschembio.6b01140 (međunarodna recenzija, članak, znanstveni)
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68.What a difference a methyl group makes - the selectivity of monoamine oxidase B towards histamine and N-methylhistamine // Chemistry : a European journal, 23 (2017), 12; 2915-2925 doi:10.1002/chem.201605430 (međunarodna recenzija, članak, znanstveni)
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69.Reversible pH switchable aggregation-induced emission of self-assembled benzimidazole-based acrylonitrile dye in aqueous solution // Dyes and pigments, 142 (2017), 108-115 doi:10.1016/j.dyepig.2017.03.021 (međunarodna recenzija, članak, znanstveni)
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70.Benzimidazole acrylonitriles as multifunctional push-pull chromophores: spectral characterisation, protonation equilibria and nanoaggregation in aqueous solutions // Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 178 (2017), 225-233 doi:10.1016/j.saa.2017.02.011 (međunarodna recenzija, članak, znanstveni)
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71.Novel pyrimidine-2,4-dione–1,2,3-triazole and furo[2,3-d]pyrimidine-2-one–1,2,3-triazole hybrids as potential anti-cancer agents: Synthesis, computational and X-ray analysis and biological evaluation // European journal of medicinal chemistry, 125 (2017), 1247-1267 doi:10.1016/j.ejmech.2016.11.028 (međunarodna recenzija, članak, znanstveni)
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72.Empirical Valence Bond Simulations of the Hydride- Transfer Step in the Monoamine Oxidase A Catalyzed Metabolism of Noradrenaline // The journal of physical chemistry. B, Condensed matter, materials, surfaces, interfaces & biophysical, 120 (2016), 44; 11419-11427 doi:10.1021/acs.jpcb.6b09011 (međunarodna recenzija, članak, znanstveni)
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73.The Use of Multiscale Molecular Simulations in Understanding a Relationship between the Structure and Function of Biological Systems of the Brain: The Application to Monoamine Oxidase Enzymes // Frontiers in Neuroscience, 10 (2016), 327, 24 doi:10.3389/fnins.2016.00327 (međunarodna recenzija, pregledni rad, znanstveni)
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74.The Chemistry of Neurodegeneration: Kinetic Data and Their Implications // Molecular neurobiology, 53 (2016), 3400-3415 doi:10.1007/s12035-015-9284-1 (međunarodna recenzija, članak, znanstveni)
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75.15N NMR Spectroscopy, X-ray and Neutron Diffraction, Quantum-Chemical Calculations, and UV/vis-Spectrophotometric Titrations as Complementary Techniques for the Analysis of Pyridine-Supported Bicyclic Guanidine Superbases // Journal of organic chemistry, 81 (2016), 17; 7612-7625 doi:10.1021/acs.joc.6b01330 (međunarodna recenzija, članak, znanstveni)
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76.The Quantum Nature of Drug-Receptor Interactions: Deuteration Changes Binding Affinities for Histamine Receptor Ligands // PLoS One, 11 (2016), e0154002-e0154002 doi:10.1371/journal.pone.0154002 (međunarodna recenzija, članak, znanstveni)
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77.Path Integral Simulation of the H/D Kinetic Isotope Effect in Monoamine Oxidase B Catalyzed Decomposition of Dopamine // The journal of physical chemistry. B, Condensed matter, materials, surfaces, interfaces & biophysical, 120 (2016), 14; 3488-3492 doi:10.1021/acs.jpcb.6b00894 (međunarodna recenzija, članak, znanstveni)
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78.Synthesis and characterization of ML and ML2 metal complexes with amino acid substituted bis(2-picolyl)amine ligands // Dalton transactions, 45 (2016), 7; 2845-2858 doi:10.1039/C5DT03387J (međunarodna recenzija, članak, znanstveni)
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79.Supramolecular Ionic-Liquid Gels with High Ionic Conductivity // Chemistry : a European journal, 21 (2015), 34; 12121-12128 doi:10.1002/chem.201500887 (međunarodna recenzija, članak, znanstveni)
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80.5-Triazolyluracils and Their N1-Sulfonyl Derivatives: Intriguing Reactivity Differences in the Sulfonation of Triazole N1'-Substituted and N1'-Unsubstituted Uracil Molecules // European journal of organic chemistry, 35 (2015), 7695-7704 doi:10.1002/ejoc.201501088 (međunarodna recenzija, članak, znanstveni)
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81.The origin of specificity and insight into recognition between an aminoacyl carrier protein and its partner ligase // Physical Chemistry Chemical Physics, 17 (2015), 29; 19030-19038 doi:10.1039/C5CP03066H (međunarodna recenzija, članak, znanstveni)
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82.Tandem β-Elimination/hetero-Michael Addition Rearrangement of the N-Alkylated Pyridinium Oxime to O-Alkylated Pyridine Oxime Ether : An Experimental and Computational Study // Journal of organic chemistry, 80 (2015), 4; 2165-2173 doi:10.1021/jo5026755 (međunarodna recenzija, članak, znanstveni)
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83.Hydrogen bond dynamics of histamine monocation in aqueous solution: how geometric arameters influence the hydrogen bond strength // Croatica chemica acta, 87 (2014), 4; 397-405 doi:10.5562/cca2512 (međunarodna recenzija, članak, znanstveni)
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84.Empirical valence bond simulations of the hydride transfer step in the monoamine oxidase B catalyzed metabolism of dopamine // Proteins, 82 (2014), 12; 3347-3355 doi:10.1002/prot.24690 (međunarodna recenzija, članak, znanstveni)
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85.Engineering exceptionally strong oxygen superbases with 1, 8-diazanaphthalene di-N-oxides // Chemical communications, 50 (2014), 75; 10941-10944 doi:10.1039/C4CC05125D (međunarodna recenzija, članak, znanstveni)
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86.Exploring the biological promiscuity of high- throughput screening hits through DFT calculations // Bioorganic & medicinal chemistry, 22 (2014), 8; 2461-2461 doi:10.1016/j.bmc.2014.02.055 (međunarodna recenzija, članak, znanstveni)
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87.Examining electrostatic preorganization in monoamine oxidases A and B by structural comparison and pKa calculations // The journal of physical chemistry. B, Condensed matter, materials, surfaces, interfaces & biophysical, 118 (2014), 16; 4326-4332 doi:10.1021/jp500795p (međunarodna recenzija, članak, znanstveni)
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88.Quantum-chemical approach to determining the high potency of clorgyline as an irreversible acetylenic monoamine oxidase inhibitor // Journal of neural transmission, 120 (2013), 6; 875-882 doi:10.1007/s00702-013-1016-y (međunarodna recenzija, članak, znanstveni)
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89.Binding of cadmium dication to glutathione facilitates cysteine -SH deprotonation: A computational DFT study // Journal of inorganic biochemistry, 119 (2013), 90-94 doi:10.1016/j.jinorgbio.2012.11.004 (međunarodna recenzija, članak, znanstveni)
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90.Ring Strain and Other Factors Governing the Basicity of Nitrogen Heterocycles - An Interpretation by Triadic Analysis // Croatica chemica acta, 85 (2012), 4; 495-504 doi:10.5562/cca2121 (međunarodna recenzija, članak, znanstveni)
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91.How are Biogenic Amines Metabolized by Monoamine Oxidases? // European journal of organic chemistry, 2012 (2012), 36; 7057-7065 doi:10.1002/ejoc.201201122 (međunarodna recenzija, članak, znanstveni)
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92.Advances in Determining the Absolute Proton Affinities of Neutral Organic Molecules in the Gas Phase and Their Interpretation : A Theoretical Account // Chemical reviews, 112 (2012), 10; 5240-5270 doi:10.1021/cr100458v (međunarodna recenzija, članak, znanstveni)
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93.Computational Study of the pKa Values of Potential Catalytic Residues in the Active Site of Monoamine Oxidase B // Journal of chemical theory and computation, 8 (2012), 10; 3864-3870 doi:10.1021/ct300119u (međunarodna recenzija, članak, znanstveni)
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94.Microsolvation of the histamine monocation in aqueous solution : the effect on structure, hydrogen bonding ability and vibrational spectrum // New journal of chemistry, 36 (2012), 954-962 doi:10.1039/C2NJ20877F (međunarodna recenzija, članak, znanstveni)
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95.Irreversible Inhibition of Monoamine Oxidase B by the Antiparkinsonian Medicines Rasagiline and Selegiline: A Computational Study // European journal of organic chemistry, 2011 (2011), 32; 6419-6433 doi:10.1002/ejoc.201100873 (međunarodna recenzija, članak, znanstveni)
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96.Protonation of Azines and Purines as a Model for the Electrophilic Aromatic Substitution – Rationalization by Triadic Formula // Acta chimica Slovenica, 58 (2011), 3; 509-520 (međunarodna recenzija, članak, znanstveni)
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97.Hydrogen Bond Dynamics of Histamine Monocation in Aqueous Solution: Car-Parrinello Molecular Dynamics and Vibrational Spectroscopy Study // The journal of physical chemistry. B, Condensed matter, materials, surfaces, interfaces & biophysical, 115 (2011), 19; 5999-6010 doi:10.1021/jp111175e (međunarodna recenzija, članak, znanstveni)
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98.Polycyano Derivatives of some Organic Tri- and Hexacyclic Molecules are Powerful Super- and Hyperacids in the Gas-Phase and DMSO - Computational Study by DFT Approach // Journal of organic chemistry, 75 (2010), 22; 7670-7681 doi:10.1021/jo101581a (međunarodna recenzija, članak, znanstveni)
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99.Superbasicity of a Bis-guanidino Compound with a Flexible Linker : A Theoretical and Experimental Study // Journal of the American Chemical Society, 131 (2009), 46; 16858-16868 doi:10.1021/ja906618g (međunarodna recenzija, članak, znanstveni)
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100.Acidifying Effect of an N-Oxide Group - A Useful Motif in Enhancing Acidity towards Superacidic Values // Croatica Chemica Acta, 82 (2009), 1; 27-39 (međunarodna recenzija, članak, znanstveni)
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101.The engineering of powerful non-ionic superacids in silico - a DFT-B3LYP study of open chain polycyanopolyenes // New Journal of Chemistry, 33 (2009), 4; 739-748 doi:10.1039/b816922e (međunarodna recenzija, članak, znanstveni)
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102.Rees polycyanated hydrocarbons and related compounds are extremely powerful Broensted superacids in the gas-phase and DMSO - a density functional B3LYP study // New journal of chemistry, 32 (2008), 3; 413-427 doi:10.1039/B713173A (međunarodna recenzija, članak, znanstveni)
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103.Interpretation of Broensted Acidity by Triadic Paradigm: A G3 Study of Mineral Acids // Journal of Physical Chemistry A, 111 (2007), 45; 11718-11724 (međunarodna recenzija, članak, znanstveni)
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104.Aromaticity of Rees-type Hydrocarbons - a DFT Computational Study // Structural Chemistry, 18 (2007), 6; 821-826 (međunarodna recenzija, članak, znanstveni)
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105.Design of Bronsted Neutral Organic Bases and Superbases by Computational DFT Methods: Cyclic and Polycyclic Quinones and [3]Carbonylradialenes // European Journal of Organic Chemistry, 2007 (2007), 20; 3402-3413 (međunarodna recenzija, članak, znanstveni)
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106.The Physical Origin of Chemical Phenomena - Interpretation of Acidity, Basicity and Hydride Affinity by Trichotomy Paradigm // Pure and Applied Chemistry, 79 (2007), 6; 1003-1021 (međunarodna recenzija, članak, znanstveni)
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107.Computational design of Bronsted neutral organic superbases - [3]iminoradialenes and quinonimines are important synthetic targets // New Journal of Chemistry, 31 (2007), 52-62 (međunarodna recenzija, članak, znanstveni)
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108.Hydride Affinities of Substituted Alkenes: Their Prediction by Density Functional Calculations and Rationalisation by Triadic Formula // European Journal of Organic Chemistry, 4 (2007), 526-539 (međunarodna recenzija, članak, znanstveni)
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109.Engineering Neutral Organic Bases and Superbases by Computational DFT Methods - Carbonyl Polyenes // European Journal of Organic Chemistry, 24 (2006), 5505-5514 (međunarodna recenzija, članak, znanstveni)
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110.Hydride Affinities of some Substituted Alkynes - Prediction by DFT Calculations and Rationalization by Triadic Formula // The Journal of Physical Chemistry A, 110 (2006), 47; 12870-12881 (međunarodna recenzija, članak, znanstveni)
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111.Basicity of amines in the gas phase - Analysis of the base-strengthening effect of an N-trityl group by use of a triadic formula // European Journal of Organic Chemistry, 11 (2006), 2581-2589 (međunarodna recenzija, članak, znanstveni)
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112.Triadic analysis of substituent effects - gas-phase acidity of para-substituted phenols // Tetrahedron, 62 (2006), 3402-3411 (međunarodna recenzija, članak, znanstveni)
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113.Towards highly powerful neutral organic superacids - a DFT study of some polycyano derivatives of planar hydrocarbons // Tetrahedron, 61 (2005), 39; 9381-9390 (međunarodna recenzija, članak, znanstveni)
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114.Extremal Acidity of Rees Polycyanated Hydrocarbons in the Gas Phase and DMSO - a Density Functional Study // Chemical communications, 27 (2005), 3412-3414 (međunarodna recenzija, članak, znanstveni)
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115.Strong acidity of some polycyclic aromatics annelated to the cyclopentadiene moiety and their cyano derivatives - A density functional B3LYP study // European journal of organic chemistry, 16 (2005), 3571-3580 (međunarodna recenzija, članak, znanstveni)
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116.High acidity of polycyano azatriquinanes - theoretical prediction by the DFT calculations // Tetrahedron letters, 46 (2005), 3711-3713 (međunarodna recenzija, članak, znanstveni)
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117.Hydride Affinities of Borane Derivatives: Novel Approach in Determining the Origin of Lewis Acidity Based on Triadic Formula // Inorganic Chemistry, 44 (2005), 1095-1102 (međunarodna recenzija, članak, znanstveni)
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118.Gas-phase acidity of para-substituted benzoic acids - a triadic analysis of substituent effects // Journal of physical organic chemistry, 18 (2005), 699-705 (međunarodna recenzija, članak, znanstveni)
-
119.Acidities of Azoles in the Gas Phase and in DMSO - An Ab Initio and DFT Study // Molecular physics, 103 (2005), 209-219 (međunarodna recenzija, članak, znanstveni)
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120.Hydrogen bonding in complex of serine with histidine : computational and spectroscopic study of model compounds // Chemical physics letters, 400 (2004), 1-3; 117-121 doi:10.1016/j.cplett.2004.10.089 (međunarodna recenzija, članak, znanstveni)
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121.Extending Acidity Ladder of Neutral Organic Superacids - A DFT-B3LYP Study of Deprotonation of Nonacyanofluorene // Tetrahedron letters, 45 (2004), 8663-8666 (međunarodna recenzija, članak, znanstveni)
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122.Acidity of Bronsted CH Acids in DMSO - The Extreme Acidity of Nonacyanocyclononatetraene // European journal of organic chemistry, 24 (2004), 5003-5010 (međunarodna recenzija, članak, znanstveni)
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123.In Search of Ultrastrong Bronsted Neutral Organic Superacids - A DFT Study of some Cyclopentadiene Derivatives // Chemistry-A European Journal, 10 (2004), 5751-5761 (međunarodna recenzija, članak, znanstveni)
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124.Design of Strong Neutral Organic Superacids: DFT-B3LYP Calculations on some Isobenzofulvene Derivatives // European Journal of Organic Chemistry, 9 (2004), 1940-1945 (međunarodna recenzija, članak, znanstveni)
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125.Tailoring of Strong Neutral Organic Superacids: DFT-B3LYP Calculations on some Fulvene Derivatives // New journal of chemistry, 28 (2004), 843-846 (međunarodna recenzija, članak, znanstveni)
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126.On the Atomic Additivity of the Zero Point Vibrational Energy in Molecules // Journal of molecular structure. Theochem, 1-3 (2004), 672; 201-207 (međunarodna recenzija, članak, znanstveni)
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127.A Combined Ab Initio and Density Functional Study of the Electronic Structure of Thymine and 2-Thiothymine Radicals // Collection of Czechoslovak chemical communications, 68 (2003), 12; 2322-2334 (međunarodna recenzija, članak, znanstveni)
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128.Computer Aided Design of Organic Superbases - The Role of Intramolecular Hydrogen Bonding // New Journal of Chemistry, 26 (2002), 1329-1334 (međunarodna recenzija, članak, znanstveni)
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129.How Good is Koopmans' Approximation? - G2(MP2) Study of the Vertical and Adiabatic Ionization Potentials of Some Small Molecules // Journal of Physical Chemistry A, 106 (2002), 6515-6520 (međunarodna recenzija, članak, znanstveni)
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130.In Search for Neutral Organic Superbases - Iminopolyenes and Their Amino Derivatives // New Journal of Chemistry, 26 (2002), 1324-1328 (međunarodna recenzija, članak, znanstveni)
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131.Anionic vs. Neutral Protonation - An Ab Initio Analysis with a Triadic Formula // ChemPhysChem, 3 (2002), 8; 696-700 (međunarodna recenzija, članak, znanstveni)
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132.Quest for the Origin of Basicity: Initial vs. Final State Effect in Neutral Nitrogen Bases // Journal of Physical Chemistry A, 106 (2002), 419-430 (međunarodna recenzija, članak, znanstveni)
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133.The Proton Affinity of Some Extended pi-Systems Involving Guanidine and Cyclopropenimine Subunits // Journal of the Chemical Society. Perkin Transactions 2, - (2001), -; 886-891 doi:10.1039/B101213O (međunarodna recenzija, članak, znanstveni)
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1.Inovativna rješenja u katalitičkim proizvodnim procesima za potrebe farmaceutske industrije (CAT PHARMA) // Kemija u industriji : časopis kemičara i tehnologa Hrvatske, 70 (2021), 11-12; 756-757 (osvrt, stručni)
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2.Scientific Journey of Zvonimir Maksić // Croatica chemica acta, 82 (2009), CXIX-CXXXI (podatak o recenziji nije dostupan, zivotopis, ostalo)
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3.Editorial // Croatica chemica acta, 82 (2009), CXVII-CXVII (podatak o recenziji nije dostupan, uvodnik, ostalo)
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4.Znanstvena izvrsnost i kompetitivnost // Kemija u industriji, 57 (2008), 3; 123-126 (podatak o recenziji nije dostupan, članak, ostalo)
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5.O znanstvenoj produktivnosti i kriterijima izvrsnosti // Kemija u industriji, 56 (2007), 4; 227-228 (podatak o recenziji nije dostupan, ostalo)
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6.Comment on the paper "On the Limits of Highest-Occupied Molecular Orbital Driven Reactions: The Frontier Effective-for-Reaction Molecular Orbital Concept" // The Journal of Physical Chemistry A, 110 (2006), 10651-10652 (podatak o recenziji nije dostupan, komentar, znanstveni)
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1.Utjecaj deuteriranja na afinitet antagonista adenozinskog A2A receptora // Simpozij o katalizi u farmaceutskoj industriji: završna konferencija CAT PHARMA projekta : knjiga sažetaka / Majerić Elenkov, Maja ; Vianello, Robert ; Kirin, Srećko I. (ur.).
Zagreb, 2023. str. 6-6 (predavanje, sažetak, znanstveni) -
2.Enzimska sinteza kiralnih građevnih blokova upotrebom halogenhidrin-dehalogenaza // Simpozij o katalizi u farmaceutskoj industriji: završna konferencija CAT PHARMA projekta : knjiga sažetaka / Majerić Elenkov, Maja ; Vianello, Robert ; Kirin, Srećko I (ur.).
Zagreb, 2023. str. 8-8 (predavanje, sažetak, znanstveni) -
3.Zeleno, zelenije, u računalu! Uloga računalnih metoda u kemiji i biokemiji // Druga stručna konferencija "Zelena kemija - mogućnosti i izazovi" : knjiga sažetaka / Hranjec, Marijana ; Gazivoda Kraljević, Tatjana (ur.).
Zagreb: Fakultet kemijskog inženjerstva i tehnologije Sveučilišta u Zagrebu, 2023. str. 8-8 (pozvano predavanje, domaća recenzija, sažetak, znanstveni) -
4.ML2 Metal complexes with bpa and imda ligands – In solution and solid-state // International Conference Solutions in Chemistry 2022 : Book of Abstracts / Kassal, Petar ; Meštrović, Ernest ; Namjesnik, Danijel ; Ribić, Rosana ; Šekutor, Marina ; Tomišić, Vladislav ; Usenik, Andrea (ur.).
Zagreb: Hrvatsko kemijsko društvo, 2022. str. 65-65 (predavanje, domaća recenzija, sažetak, znanstveni) -
5.Deep eutectic solvent system based on amino acids derivatives // Solutions in Chemistry, Book of Abstracts / Kassal, Petar ; Meštrović, Ernest ; Namjesnik, Danijel ; Ribić, Rosana ; Šekutor, Marina ; Tomišić, Vladislav ; Usenik, Andrea (ur.).
Zagreb: Hrvatsko kemijsko društvo, 2022. str. 119-119 (poster, međunarodna recenzija, sažetak, znanstveni) -
6.Utilization of a kinetic isotope effect to decrease decomposition of ceftriaxone in a mixture of D2O/H2O // Solutions in Chemistry, Book of Abstracts / Kassal, Petar ; Meštrović, Ernest ; Namjesnik, Danijel ; Ribić, Rosana ; Šekutor, Marina ; Tomišić, Vladislav ; Usenik, Andrea (ur.).
Zagreb: Hrvatsko kemijsko društvo, 2022. str. 96-96 (poster, međunarodna recenzija, sažetak, znanstveni) -
7.Imidazo[4,5-b]pyridine Derived Tubulin Polymerization Inhibitors // Šesti mini simpozij medicinske i farmaceutske kemije HKD-a
Zagreb, Hrvatska, 2022. str. 12-12 (predavanje, podatak o recenziji nije dostupan, sažetak, znanstveni) -
8.An insight into the mechanism of the irreversible inhibition of monoamine oxidase enzymes by propargylamine inhibitors // 12th JMMC – Joint meeting on medicinal chemistry: book of abstracts / Májeková, Magdaléna ; Heger, Vladimir ; Kováčiková, Lucia ; Šoltésová Prnová, Marta ; Šramel, Peter (ur.).
Bratislava: Slovenská toxikologická spoločnosť SETOX, 2022. str. 29-29 (plenarno, međunarodna recenzija, sažetak, znanstveni) -
9.Stereokemija ML2 metalnih kompleksa s bpa i imda ligandima // SiSK7, 7. Simpozij studenata kemičara : knjiga sažetaka / Topić, Magda (ur.).
Zagreb: Studentska sekcija Hrvatskog kemijskog društva (SSHKD), 2022. str. 70-70 (poster, sažetak, znanstveni) -
10.COVID-19 Infection and Neurodegeneration: A Potential Link Revealed by Computational Simulations // 23rd EuroQSAR, 23rd European Symposium on Quantitative Structure- Activity Relationship, Integrative Data-Intensive Approaches to Drug Design : Book of Abstracts
Heidelberg, Njemačka, 2022. str. 233-233 (poster, međunarodna recenzija, sažetak, znanstveni) -
11.COVID-19 Infection and Neurodegeneration: A Potential Link Revealed by Computational Simulations // Computational Chemistry Day 2022 : Book of Abstracts
Zagreb: Ruđer Bošković Institute, 2022. str. 36-36 (poster, domaća recenzija, sažetak, znanstveni) -
12.Design and Development of Novel pH-Sensors Based on Iminocoumarin Derived Imidazo[4,5-b]pyridines // Computational Chemistry Day 2022 : Book of Abstracts
Zagreb: Ruđer Bošković Institute, 2022. str. 47-47 (poster, domaća recenzija, sažetak, znanstveni) -
13.Computational Study of the Monoamine Oxidase B Mechanism-Based Irreversible Inhibitors // Computational Chemistry Day 2022 : Book of Abstracts
Zagreb: Ruđer Bošković Institute, 2022. str. 20-20 (poster, domaća recenzija, sažetak, znanstveni) -
14.COVID-19 Infection and Neurodegeneration: A Potential Link Revealed by Computational Simulations // 19th Ružička days "Today science – tomorrow industry" : book of abstracts = 19. međunarodni znanstveno-stručni skup Ružičkini dani "Danas znanost - sutra industrija" : knjiga sažetaka / Babić, Jurislav (ur.).
Osijek : Zagreb: Sveučilište Josipa Jurja Strossmayera u Osijeku Prehrambeno-tehnološki fakultet Osijek ; Hrvatsko društvo kemijskih inženjera i tehnologa, 2022. str. 116-116 (poster, domaća recenzija, sažetak, znanstveni) -
15.Synthesis and biological activity of novel amidino-substituted imidazo[4,5-b]pyridines // 19th Ružička days "Today science – tomorrow industry" : book of abstracts = 19. međunarodni znanstveno-stručni skup Ružičkini dani "Danas znanost - sutra industrija" : knjiga sažetaka / Babić, Jurislav (ur.).
Osijek : Zagreb: Sveučilište Josipa Jurja Strossmayera u Osijeku Prehrambeno-tehnološki fakultet Osijek, Hrvatsko društvo kemijskih inženjera i tehnologa, 2022. str. 111-111 (poster, međunarodna recenzija, sažetak, znanstveni) -
16.Computational Analysis of the Stereochemistry of ML2 Metal Complexes With Bpa and Imda Ligands // Computational Chemistry Day 2022 : Book of Abstracts
Zagreb: Ruđer Bošković Institute, 2022. str. 44-44 (poster, domaća recenzija, sažetak, znanstveni) -
17.Synthesis, antiproliferative activity and DNA binding of amino and amido substituted pentacyclic benzimidazole derivatives // 8th EuChemS Chemistry : Book of abstracts / Silva, Artur M. S. ; Galvão, Adelino M. ; Machado, Bruno F. ; Faria, Joaquim L. (ur.).
Lisabon: Sociedade Portuguesa de Química, 2022. str. 608-608 (poster, međunarodna recenzija, sažetak, znanstveni) -
18.The influence of the nitrogen position on the spectroscopic properties of regioisomers based on imidazo[4,5-b]pyridine // 8th EuChemS Chemistry Congress : Book of abstracts / Silva, Artur M. S. ; Galvão, Adelino M. ; Machado, Bruno F. ; Faria, Joaquim L. (ur.).
Lisabon: Sociedade Portuguesa de Química, 2022. str. 755-755 (poster, međunarodna recenzija, sažetak, znanstveni) -
19.Harmiquins, novel potent antiplasmodial hits // 9th BBBB International Conference on Pharmaceutical Sciences, Book of Abstracts / Obreza, Aleš ; Dreu, Rok ; Zvonar Pobirk, Alenka ; Sterle Zorec, Barbara (ur.).
Ljubljana: Slovensko farmacevtsko društvo in Univerza v Ljubljani, Fakulteta za farmacijo, 2022. str. 224-225 (poster, međunarodna recenzija, sažetak, znanstveni) -
20.Zeleno, zelenije, u računalu! Uloga računalnih metoda u kemiji i biokemiji. // 3. ZORH susret : knjiga sažetaka = 3rd ZORH conference : Book of Abstracts / Brajković, Petra ; Matošin, Ante ; Mužek, Mario Nikola (ur.).
Split: Kemijsko-tehnološki fakultet Sveučilišta u Splitu, 2022. str. 63-63 (pozvano predavanje, međunarodna recenzija, sažetak, znanstveni) -
21.Synthesis and spectroscopic characterization of benzimidazole derivatives as potential pH sensors // 8th international conference on new trends in chemistry : 8th ICNTC book of abstracts / Şakar Daşdan, Dolunay (ur.).
Istanbul: ICNTC Secretariat, 2022. str. 59-59 (poster, međunarodna recenzija, sažetak, znanstveni) -
22.Novel iminocoumarine derived imidazo[4,5-b]pyridnes as potential antioxidants // 8th ICNTC Book of abstracts / Şakar Daşdan, Dolunay (ur.).
online: ICNTC Secretariat, 2022. str. 54-54 (poster, međunarodna recenzija, sažetak, znanstveni) -
23.Computational Study of Neurodegeneration Related to COVID-19 Infection // XIV. susret mladih kemijskih inženjera : knjiga sažetaka = XIV Meeting of Young Chemical Engineers : Book of Abstracts / Žižek, Krunoslav ; Katančić, Zvonimir ; Kovačić, Marin (ur.).
Zagreb: Hrvatsko društvo kemijskih inženjera i tehnologa (HDKI), 2022. str. 14-14 (predavanje, domaća recenzija, sažetak, znanstveni) -
24.Reactivity and thermal behaviour of 7-methyl- 2h,3h,7h-imidazo[2,1-b]thiazol-4-ium chloride // 27th Croatian Meeting of Chemists and Chemical Engineers and 5th Symposium Vladimir Prelog : Book of Abstracts / Marković, Dean ; Meštrović, Ernest ; Namjesnik, Danijel ; Tomašić, Vesna (ur.).
Zagreb: Hrvatsko društvo kemijskih inženjera i tehnologa,, 2021. str. 252-252 (poster, međunarodna recenzija, sažetak, znanstveni) -
25.Natural Deep Eutectic Solvents (NADES) as a stabilising medium for nicotinamide coenzymes // Biotrans 2021 : Book of abstracts
Graz, Austrija, 2021. str. 352-352 (poster, međunarodna recenzija, sažetak, znanstveni) -
26.Thermodynamic and structural studies of complexation reactions of phenanthridine-based calix[4]arene derivative with alkaline earth metal cations // 27th Croatian Meeting of Chemists and Chemical Engineers and 5th Symposium Vladimir Prelog : Book of Abstracts / Marković, Dean ; Meštrović, Ernest ; Namjesnik, Danijel ; Tomašić, Vesna (ur.).
Zagreb: Hrvatsko kemijsko društvo, 2021. str. 275-275 (poster, domaća recenzija, sažetak, znanstveni) -
27.Novel iminocoumarin derived imidazo[4,5-b]pyridines as potential pH sensors // 27th Croatian Meeting of Chemists and Chemical Engineers : Book of abstracts / Marković, Dean ; Meštrović, Ernest ; Namjesnik, Danijel ; Tomašić, Vesna (ur.).
Zagreb: Hrvatsko kemijsko društvo, 2021. str. 145-145 (poster, međunarodna recenzija, sažetak, znanstveni) -
28.COVID-19 Infection and Neurodegeneration: A Potential Link Revealed by Computational Simulations // 27th Croatian Meeting of Chemists and Chemical Engineers and 5th Symposium Vladimir Prelog : Book of Abstracts / Marković, Dean ; Meštrović, Ernest ; Namjesnik, Danijel ; Tomašić, Vesna (ur.).
Zagreb: Hrvatsko kemijsko društvo, 2021. str. 197-197 (poster, međunarodna recenzija, sažetak, znanstveni) -
29.Synthesis and biological activity of novel n- substituted benzimidazole derived acrylonitriles // EFMC-ISMC International Symposium on Medicinal Chemistry, Virtual Event, Book of Abstracts
Basel, Švicarska, 2021. str. 407-407 (poster, međunarodna recenzija, sažetak, znanstveni) -
30.Synthesis and antioxidative activity of novel acrylonitrile imidazo[4,5-b]pyridines // Book of abstracts, EFMC-ISMC, International Symposium on Medicinal Chemistry
Basel, Švicarska, 2021. str. 406-406 (poster, međunarodna recenzija, sažetak, znanstveni) -
31.Deuteration affects histamine affinity for its H2 receptor: a computational study // Simpozij studenata doktorskih studija PMF-a : knjiga sažetaka = PhD student symposium 2021 : book of abstracts / Barišić, Dajana (ur.).
Zagreb: Prirodoslovno-matematički fakultet Sveučilišta u Zagrebu, 2021. str. 328-329 (poster, domaća recenzija, sažetak, znanstveni) -
32.A computational insight into the effect of deuteration on the H2 receptor histamine binding profile // 18th Hellenic Symposium on Medicinal Chemistry : Abstract Book
online, 2021. 21, 1 (predavanje, međunarodna recenzija, sažetak, znanstveni) -
33.A computational insight into the mechanism of the irreversible inhibition of monoamine oxidase enzymes by the antiparkinsonian propargylamine inhibitors rasagiline and selegiline // 18th Hellenic Symposium on Medicinal Chemistry : Abstract Book
online, 2021. 133, 1 (poster, međunarodna recenzija, sažetak, znanstveni) -
34.Effect of the linker length and amide group orientation on chiral bpa complexes of Zn(II) and Cu(II) // XIII Meeting of Young Chemical Engineers : Book of Abstracts
Zagreb, Hrvatska, 2020. str. 176-176 (poster, sažetak, znanstveni) -
35.Computational insight into the metal-free cleavage of the carbon-carbon triple bond in alkynes // 17th European Symposium on Organic Reactivity (ESOR 2019), Book of abstracts / Vančik, Hrvoj ; Namjesnik, Danijel (ur.).
Zagreb: Hrvatsko kemijsko društvo, 2019. str. 93-93 (poster, međunarodna recenzija, sažetak, znanstveni) -
36.Reakcijski mehanizam transaciliranja ferocenoil-purina. Računalna studija // 8. Simpozij studenata farmacije i medicinske biokemije, FARMEBS 2019. - Knjiga Sažetaka / Bojić, Mirza ; Somborac Bačura, Anita (ur.).
Zagreb: Farmaceutsko-biokemijski fakultet Sveučilišta u Zagrebu, 2019. str. 34-34 (poster, domaća recenzija, sažetak, ostalo) -
37.Irreversible inhibition of the MAO B enzyme. A computational insight into the inactivation mechanism // 17th European Symposium on Organic Reactivity (ESOR 2019), Book of abstracts / Vančik, Hrvoj ; Namjesnik, Danijel (ur.).
Zagreb: Croatian Chemistry Society, Zagreb, 2019. str. 92-92 (poster, međunarodna recenzija, sažetak, ostalo) -
38.Counterion effects on the formation of isopropyl-bis(2-picolyl)amine (iPr-bpa) complexes with Zn(II) and Cu(II) // Book of Abstracts
Moskva, Ruska Federacija, 2019. str. 170-170 (poster, međunarodna recenzija, sažetak, znanstveni) -
39.Substituent Influence on the Solution State Structure of Iminodiacetamide Complexes with Late Transition Metals // Book of Abstracts
Bratislava: Slovak Chemical Society, 2019. str. 79-79 (predavanje, sažetak, znanstveni) -
40.Direct Transformation of Alkynes to Nitriles: Quantum-Chemical Study of the Reaction Mechanism // Computational Chemistry Day 2019 : Book of abstracts
Zagreb: Prirodoslovno-matematički fakultet Sveučilišta u Zagrebu, 2019. str. 20-20 (poster, sažetak, znanstveni) -
41.Computational insight into the MAO B enzyme irreversible inhibition // Computational Chemistry Day 2019, Book of abstracts
Zagreb: Prirodoslovno-matematički fakultet Sveučilišta u Zagrebu, 2019. str. 9-9 (predavanje, sažetak, znanstveni) -
42.Synthesis and Characterization of 1, 2, 3-Triazole Ligands and their Transition Metal Complexes // 26th Croatian Meeting of Chemists and Chemical Engineers : book of abstracts
Šibenik, Hrvatska, 2019. str. 134-134 (poster, sažetak, znanstveni) -
43.Test strips for mercury (II) detection based on fluorescent benzimidazole derivatives as optical transducers // 26. Hrvatski skup kemičara i kemijskih inženjera, Knjiga sažetaka / Galić, Nives ; Rogošić, Marko (ur.).
Zagreb: Hrvatsko društvo kemijskih inženjera i tehnologa (HDKI), 2019. str. 79-79 (poster, domaća recenzija, sažetak, znanstveni) -
44.Spektroskopske karakteristike i imobilizacija fluorescentnih amino supstituiranih benzimidazo[1, 2-a]kinolina // 26. Hrvatski skup kemičara i kemijskih inženjera, Knjiga sažetaka / Galić, Nives ; Rogošić, Marko (ur.).
Zagreb: Hrvatsko društvo kemijskih inženjera i tehnologa (HDKI), 2019. str. 117-117 (poster, domaća recenzija, sažetak, znanstveni) -
45.Application of Fluorescent Benzimidazole Derivatives in Functional Materials: a Mercury (II) Sensitive Chemodosimeter // 6th International Conference on Multifunctional, Hybrid and Nanomaterials
Sitges, 2019. str. P3086-P3086 (poster, međunarodna recenzija, sažetak, znanstveni) -
46.Computational modeling of histamine metabolism in humans // Book of Abstract Understanding Movement and Mechanism in Molecular Machines / Maltar Strmečki, Nadica ; Štajner, Lara ; Maršavelski, Aleksandra (ur.).
Zagreb, 2018. str. 11-11 (poster, podatak o recenziji nije dostupan, sažetak, znanstveni) -
47.Spectroscopic and computational study of novel pH sensitive probes based on benzo[b]thienopyridil- benzimidazoles // 7th EuCheMS Chemistry Congress: Molecular frontiers & global challenges
Liverpool, 2018. PP67, 1 (poster, međunarodna recenzija, sažetak, znanstveni) -
48.Amino substituted benzamide derivatives as potential antioxidants // 17. Ružičkini dani "Danas znanost – sutra industrija" : knjiga sažetaka = 17th Ružička days "Today science – tomorrow industry" : Book of Abstracts / Tomas, Srećko ; Ačkar, Đurđica (ur.).
Zagreb: Prehrambeno tehnološki fakultet Sveučilišta Josipa Jurja Strossmayera u Osijeku ; Hrvatsko društvo kemijskih inženjera i tehnologa (HDKI), 2018. str. 27-27 (poster, međunarodna recenzija, sažetak, znanstveni) -
49.Irreversible inhibition of monoamine oxidase B enzyme. A computational insight. // Book of abstracts - 5th EFMC Young Medicinal Chemist Symposium.
Ljubljana, Slovenija, 2018. str. 112-112 (poster, međunarodna recenzija, sažetak, znanstveni) -
50.Irreversible inhibition of monoamine oxidase B enzyme. A computational insight. // Book of abstracts EFMC-ISMC 2018 XXV EFMC International Symposium on Medicinal Chemistry.
Ljubljana, Slovenija, 2018. str. 417-417 (poster, međunarodna recenzija, sažetak, znanstveni) -
51.RAČUNALNI UVID U IREVERZIBILNU INHIBICIJU ENZIMA MONOAMINOOKSIDAZE B // Knjiga sažetaka 2. Simpozija doktorskih studija PMF-a. / Ines Primožić (ur.).
Zagreb: Prirodoslovno-matematički fakultet Sveučilišta u Zagrebu, 2018. str. 38-38 (poster, domaća recenzija, sažetak, ostalo) -
52.Irreversible inhibition of monoamine oxidase B enzyme. A computational insight // Computational Chemistry Day : Book of Abstracts
Zagreb: Prirodoslovno-matematički fakultet Sveučilišta u Zagrebu, 2018. str. 32-32 (poster, domaća recenzija, sažetak, znanstveni) -
53.Protonation equlibria and optical properties of benzo[b]thienopyridil-benzimidazoles studied by spectroscopic and computational methods // Computational Chemistry Day : Book of Abstracts
Zagreb: Prirodoslovno-matematički fakultet Sveučilišta u Zagrebu, 2018. str. 18-18 (poster, domaća recenzija, sažetak, znanstveni) -
54.Stimuli-responsive solid-state emitters based on benzimidazole moiety // EUROPT(R)ODE XIV Naples 2018, XIV Conference on optical chemical sensors and biosensors : Book of Abstracts
Napulj, Italija, 2018. str. 92-92 (poster, međunarodna recenzija, sažetak, znanstveni) -
55.Photophysical properties of fluorescent benzimidazo[1, 2-a]quinolines // Central European Conference on Photochemistry (CECP 2018) : Book of Abstracts
Bad Hofgastein, Austrija, 2018. str. 78-78 (poster, međunarodna recenzija, sažetak, ostalo) -
56.Spectroscopic and computational studies of protonation equlibria displayed by fluorescent pentacyclic benzimidazole derivatives // Central European Conference on Photochemistry (CECP 2018): Book of Abstracts
Bad Hofgastein, Austrija, 2018. str. 90-90 (poster, međunarodna recenzija, sažetak, znanstveni) -
57.Razumijevanje svojstava gelatora upotrebom računalnih simulacija // Minisimpozij Supramolekulska kemija u Hrvatskoj : dosezi i pogled u budućnost : Knjiga sažetaka = book of abstracts / Frkanec, Leo ; Namjesnik, Danijel ; Tomišić, Vladislav (ur.).
Zagreb: Institut Ruđer Bošković, 2017. str. 18-18 (predavanje, domaća recenzija, sažetak, znanstveni) -
58.Computational insight into the catalytic activity of monoamine oxidase enzyme for targeting neurological diseases // Book of Abstracts of the 10th Joint Meeting on Medicinal Chemistry / Basarić, Nikola ; Namjesnik, Danijel ; Perković, Ivana ; Stepanić, Višnja (ur.).
Zagreb: Hrvatsko kemijsko društvo, 2017. str. 55-55 (plenarno, međunarodna recenzija, sažetak, znanstveni)
