Pregled po CROSBI profilu: Robert Vianello (CROSBI Profil: 29113, MBZ: 237604, ORCID: 0000-0003-1779-4524)
Pronađeno 285 radova
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101.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) -
102.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) -
103.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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104.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) -
105.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) -
106.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) -
107.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) -
108.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) -
109.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 -
110.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) -
111.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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112.Računalom protiv neurodegenerativnih bolesti // 5. simpozij studenata kemičara (SISK5)
Zagreb, Hrvatska, 2018. (plenarno, domaća recenzija, neobjavljeni rad, znanstveni) -
113.Mechanistic Studies of Monoamine Oxidases // International Summer School "Multiscale Molecular Simulation for Neurological Targets"
Ljubljana, Slovenija, 2018. (pozvano predavanje, međunarodna recenzija, neobjavljeni rad, znanstveni) -
114.Computational insight into the selectivity and catalytic activity of monoamino oxidase for targeting neurodegenerative diseases // Computational Chemistry Day : Book of Abstracts
Zagreb: Prirodoslovno-matematički fakultet Sveučilišta u Zagrebu, 2018. (predavanje, domaća recenzija, ostalo, znanstveni) -
115.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) -
116.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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117.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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118.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) -
119.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) -
120.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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121.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) -
122.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) -
123.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) -
124.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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125.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) -
126.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) -
127.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) -
128.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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129.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) -
130.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) -
131.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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132.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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133.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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134.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) -
135.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) -
136.Računalno ispitivanje katalitičke aktivnosti i selektivnosti aminskih oksidaza prema histaminu i N-metilhistaminu, 2017., doktorska disertacija, Prirodoslovno-matematički fakultet, Zagreb
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137.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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138.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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139.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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140.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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141.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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142.Računalni uvid u reakciju ciklotrimerizacije izocijanata korištenjem bicikličkog gvanidinskog katalizatora // 25. Hrvatski skup kemičara i kemijskih inženjera s međunarodnim sudjelovanjem ; 3. simpozij Vladimir Prelog : knjiga sažetaka = 25th Croatian Meeting of Chemist and Chemical Engineers with international participation. 3rd symposium “Vladimir Prelog” : Book of Abstracts / Šantić, Ana ; Đaković, Marijana (ur.).
Zagreb: Hrvatsko kemijsko društvo ; Hrvatsko društvo kemijskih inženjera i tehnologa, 2017. str. 81-81 (predavanje, domaća recenzija, sažetak, znanstveni) -
143.Novel and efficient bicyclic guanidine catalyst for the cyclotrimerization of isocyanates : a quantum chemical study // 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. 226-226 (poster, domaća recenzija, sažetak, znanstveni) -
144.Novel para substituted n-aryl 3-hydroxypyridin- 4-one mannosides: synthesis, hemagglutination inhibitory properties and molecular modeling // 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. 119-119 (poster, domaća recenzija, sažetak, znanstveni) -
145.Hexacoordinated transition metal bpa and imda complexes // Solid-State Science & Research Meeting : Book of Abstracts / Juribašić Kulcsár, Marina ; Halasz, Ivan (ur.).
Zagreb: Institut Ruđer Bošković, 2017. str. 85-85 (poster, međunarodna recenzija, sažetak, znanstveni) -
146.Photophysical properties and immobilisation of fluorescent aminated benzimidazo[1, 2-a]quinolines // International Symposium on Macrocyclic and Supramolecular Chemistry (ISMSC) in conjunction with ISACS: Challenges in Organic Materials & Supramolecular Chemistry : Book of Abstracts
Cambridge, 2017. str. P306-P306 (poster, međunarodna recenzija, sažetak, znanstveni) -
147.Benzimidazole as a structural unit in optical chemical sensors: the hidden properties of a biologically privileged heterocyclic scaffold // 12th International Symposium on Macrocyclic and Supramolecular Chemistry in conjunction with ISACS: Book of Abstracts, Cambridge, 02.-06.07.2017.
Cambridge, Ujedinjeno Kraljevstvo, 2017. (poster, međunarodna recenzija, sažetak, znanstveni) -
148.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 -
149.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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150.Aggregation-induced emission (AIE) of self- assembled benzimidazole based acrylonitrile dye // 25. Hrvatski skup kemičara i kemijskih inženjera s međunarodnim sudjelovanjem ; 3. simpozij Vladimir Prelog : knjiga sažetaka = 25th Croatian Meeting of Chemist and Chemical Engineers with international participation. 3rd symposium “Vladimir Prelog” : Book of Abstracts / Šantić, Ana ; Đaković, Marijana (ur.).
Zagreb: Hrvatsko kemijsko društvo ; Hrvatsko društvo kemijskih inženjera i tehnologa, 2017. str. 75-75 (predavanje, domaća recenzija, sažetak, znanstveni) -
151.pH and metal sensing properties of benzimidazole based Schiff bases // 25. Hrvatski skup kemičara i kemijskih inženjera s međunarodnim sudjelovanjem ; 3. simpozij Vladimir Prelog : knjiga sažetaka = 25th Croatian Meeting of Chemist and Chemical Engineers with international participation. 3rd symposium “Vladimir Prelog” : Book of Abstracts / Šantić, Ana ; Đaković, Marijana (ur.).
Zagreb: Hrvatsko kemijsko društvo ; Hrvatsko društvo kemijskih inženjera i tehnologa, 2017. str. 262-262 (poster, domaća recenzija, sažetak, znanstveni) -
152.Antioksidativna aktivnost heteroaromatskih benzamida kao senzora za metalne ione i pH // 25. Hrvatski skup kemičara i kemijskih inženjera s međunarodnim sudjelovanjem ; 3. simpozij Vladimir Prelog : knjiga sažetaka = 25th Croatian Meeting of Chemist and Chemical Engineers with international participation. 3rd symposium “Vladimir Prelog” : Book of Abstracts / Šantić, Ana ; Đaković, Marijana (ur.).
Zagreb: Hrvatsko kemijsko društvo ; Hrvatsko društvo kemijskih inženjera i tehnologa, 2017. str. 204-204 (poster, domaća recenzija, sažetak, znanstveni) -
153.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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154.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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155.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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156.The selectivity and catalytic mechanism of monoamine oxidase enzymes from multiscale computational simulations // Advancing the Frontiers of (Bio)Chemistry with Valence Bond Approaches
Uppsala, Švedska, 2016. (pozvano predavanje, međunarodna recenzija, neobjavljeni rad, znanstveni) -
157.Computational study of the substrate specificity of monoamine oxidase B // ECS3 Book of Abstracts / Popović, Jasminka ; Višnjevac, Aleksandar (ur.).
Zagreb: Croatian Association of Crystallographers, 2016. str. 7-7 (poster, sažetak, znanstveni) -
158.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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159.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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160.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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161.Ispitivanje supstratne selektivnosti monoaminooksidaze B računalnim metodama // Simpozij studenata doktorskih studija PMF-a : knjiga sažetaka / Primožič, Ines ; Hranilović, Dubravka (ur.).
Zagreb, 2016. str. 49-49 (poster, domaća recenzija, sažetak, znanstveni) -
162.Computational study of the substrate specificity of monoamine oxidase B // Advancing the Frontiers of (Bio)Chemistry with Valence Bond Approaches
Uppsala, Švedska, 2016. str. 47-47 (poster, međunarodna recenzija, sažetak, znanstveni) -
163.Computational study of the substrate specificity of monoamine oxidase B // ECS3 Book of Abstracts
Bol, Hrvatska, 2016. str. 7-7 (poster, međunarodna recenzija, sažetak, ostalo) -
164.15N 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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165.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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166.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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167.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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168.Computational analysis of the enzyme catalysis – insight into the activity of monoamine oxidases // Computational Chemistry for Neurological Targets
Beograd, Srbija, 2015. (predavanje, međunarodna recenzija, ostalo, znanstveni) -
169.Mechanistic studies of monoamine oxidases // International Summer School: Molecular Simulation for Neurological Targets
Ljubljana, Slovenija, 2015. (pozvano predavanje, međunarodna recenzija, ostalo) -
170.Computational investigations of the B. japonicum Gly:CP ligase 1 specificity towards amino acid substrate and aminoacyl carrier protein // AMBER Molecular dynamics workshop
Haifa, Izrael, 2015. (poster, međunarodna recenzija, neobjavljeni rad, ostalo) -
171.The binding of histamine and N-methylhistamine to monoamine oxidase B and their metabolic pathways // Computational Chemistry for Neurological Targets
Beograd, Srbija, 2015. str. 25-25 (predavanje, međunarodna recenzija, sažetak, ostalo) -
172.Insight into recognition between aminoacyl carrier protein and its binding partner // 29th European Crystallographic Meeting
Rovinj, Hrvatska, 2015. str. s211-s211 (poster, međunarodna recenzija, sažetak, ostalo) -
173.Engineering Exceptionally Strong Oxygen Superbases with 1, 8-Diazanaphthalene di-N-oxides // Book of Abstracts of ESOR 2015
Kiel, Njemačka, 2015. (poster, međunarodna recenzija, sažetak, znanstveni) -
174.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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175.5-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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176.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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177.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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178.How is Serotonin Decomposed by Monoamine Oxidase A?: A QM/MM Simulation of Reactive Step // COST CM1103 Action Meeting
Smolenice, Slovačka, 2014. (predavanje, međunarodna recenzija, ostalo, znanstveni) -
179.Računalom protiv neurodegenerativnih bolesti // Odjel za biotehnologiju, Sveučilište u Rijeci
Rijeka, Hrvatska, 2014. (pozvano predavanje, ostalo, znanstveni) -
180.Computer sciences and neurodegenerative diseases // Central Europe NeuroScience CENS Advisory Board meeting
Beograd, Srbija, 2014. (pozvano predavanje, međunarodna recenzija, ostalo, znanstveni) -
181.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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182.Computational Insight into the Catalytic Activity of Monoamine Oxidase for Targeting Neurological Diseases // 6th EuCheMS Organic Division Young Investigators Workshop
Larnaca, 2014. (pozvano predavanje, međunarodna recenzija, sažetak, znanstveni) -
183.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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184.Chirality induction in ML2 metal complexes with amino acid substituted bis(2-picolyl)amine ligands // Book of Abstracts / Dr. Daniela Donghi (ur.).
Zürich: -, 2014. str. 74-74 (predavanje, međunarodna recenzija, sažetak, znanstveni) -
185.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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186.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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187.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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188.Optical characterisation and immobilization of novel benzimidazole based acrylonitrile dyes // EUROPT(R)ODE XII, Conference on Optical Chemical Sensors & Biosensors
Atena, 2014. (poster, sažetak, znanstveni) -
189.When soft is better than hard: flexible methylene group as a useful linker in designing neutral organic superbases // 23. hrvatski skup kemičara i kemijskih inženjera : knjiga sažetaka = 23. Croatian meeting of chemists and chemical engineers : book of abstracts / Hadžiev, Andrea ; Blažeković, Zdenko (ur.).
Zagreb: Hrvatsko društvo kemijskih inženjera i tehnologa (HDKI), 2013. str. 44-44 (predavanje, međunarodna recenzija, sažetak, znanstveni) -
190.How are biogenic amines metabolized by monoamine oxidases? // Summer School: From Computational Enzymology towards Molecular Docking
Ljubljana, Slovenija, 2013. (pozvano predavanje, međunarodna recenzija, sažetak, znanstveni) -
191.Computational insight into the catalytic activity and irreversible inhibition of monoamine oxidase for targeting neurological diseases // 12th National Conference on Biophysics
Iaşi, Rumunjska, 2013. (pozvano predavanje, međunarodna recenzija, sažetak, znanstveni) -
192.Recent progress in understanding the catalytic activity of monoamine oxidases // Interdisciplinary Chemical Approaches for Neuropathology
Valletta, Malta, 2013. (pozvano predavanje, međunarodna recenzija, sažetak, znanstveni) -
193.Computational analysis of the catalytic activity and irreversible inhibition of monoamine oxidase for targeting neurological diseases // 6th Central European Conference – Chemistry towards Biology
Trst, Italija, 2013. (plenarno, međunarodna recenzija, sažetak, znanstveni) -
194.Kinetic and computational study of the base promoted mechanism of N−benzoilethylpyridinium−4−aldoxime rearrangement. // XXIII Skup kemičara i kemijskih inžinjera / Hadžiev, Andrea ; Blažeković, Zdenko (ur.).
Zagreb: Hrvatsko kemijsko društvo/Hrvatsko društvo kemijskih inženjera i tehnologa, 2013. str. 174-174 (poster, domaća recenzija, sažetak, ostalo) -
195.Ring Strain and Other Factors Governing the Basicity of Nitrogen Heterocycles - An Interpretation by Triadic Analysis // Book of Abstracts of XIV European Symposium on Organic Reactivity
Prag, Češka Republika, 2013. str. 80-80 (poster, sažetak, znanstveni) -
196.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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197.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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198.Computational vibrational spectroscopy in aqueous solution: the case study of histamine monocation // IX. susret mladih kemijskih inženjera
Zagreb, Hrvatska, 2012. (predavanje, međunarodna recenzija, ostalo, znanstveni) -
199.Computational vibrational spectroscopy in aqueous solution: the case study of histamine monocation // IX. susret mladih kemijskih inženjera
Zagreb, Hrvatska, 2012. (predavanje, međunarodna recenzija, ostalo, znanstveni) -
200.How are biogenic amines metabolized by monoamine oxidases? // COST CM1103 Action Meeting
Madrid, Španjolska, 2012. (predavanje, međunarodna recenzija, ostalo, znanstveni)
