2010-2012   FP7 Marie Curie stipendist, Kemijski institut, Ljubljana, Slovenija (domaćin: dr. Janez Mavri)

2005   postdoktorand zaklade Alexander von Humboldt, Institut za organsku kemiju, Sveučilište u Heidelbergu, Njemačka (domaćin: prof. Rolf Gleiter)

05.11.2003.   doktorat prirodnih znanosti –  polje kemija, doktorska disertacija "Interakcije Lewisovih kiselina i baza". Mentor: Prof. Zvonimir Maksić

2001–2003   poslijediplomski studij fizikalne kemije, PMF, Sveučilište u Zagrebu

17.11.2000.   diplomirani inženjer kemije, diplomski rad "Protonski afiniteti nekih derivata gvanidina". Mentor: Prof. Zvonimir Maksić

1996–2000   studij kemije, PMF, Sveučilište u Zagrebu

1992–1996   Prva sušačka hrvatska gimnazija, Rijeka

1984–1992   redovno osnovnoškolsko obrazovanje, O.Š. "Ivan Zajc", Rijeka

2015-2019   "Dizajn i sinteza novih dušikovih heterocikličkih fluorofora i fluorescentnih nanomaterijala kao kemijskih senzora za pH i metalne ione"; istraživački projekt Hrvatske zaklade za znanost

2013-2017   "Computational Studies of the Biogenic Amines of the Brain for Targeting Neurological Diseases"; individualni FP7 Marie Curie Career Integration Grant (FP7-PEOPLE-2012-CIG natječaj)

2011-2014   "Broenstedove i Lewisove kiseline i baze u kemiji i biokemiji"; temeljni projekt MZOŠ-a

2010-2012   "Computational Studies of Proton Dynamics in Hydrogen Bonded Systems and Enzymes"; individualna FP7 Marie Curie stipendija (FP7-PEOPLE-2009-IEF natječaj) za 18 mjesečno poslijedoktorsko usavršavanje na Kemijskom institutu u Ljubljani (Slovenija)

2008-2010   "Računsko predviđanje strukture i katalitičke aktivnosti novih organskih superkiselina"; Fond "Jedinstvo uz pomoć znanja", Program za mlade znanstvenike i stručnjake, uz sufinanciranje tvrtke APO d.o.o. Zagreb

2009-2010   "Kiselo bazna i tautomerna svojstva biološki važnih spojeva u otopini"; hrvatsko-slovenski bilateralni projekt

2008-2009   "Amidna veza i njene implikacije u molekularnoj biologiji"; austrijsko-hrvatski bilateralni projekt

2018   Godišnja nagrada Zaklade Branimir Jernej za izniman znanstveni rad objavljen u 2017. godini

2017   Državna nagrada za znanost za 2016. godinu u području prirodnih znanosti; Ministarstvo znanosti i obrazovanja i Sabor Republike Hrvatske

2015   Godišnja nagrada ravnatelja Instituta Ruđer Bošković za 2015. godinu za rad u časopisu s visokim faktorom utjecaja

2013   predstavljanje na službenoj stranici Europske komisije (http://www.croatia-in-the-eu.eu) kojom je najavljivan ulazak Republike Hrvatske u punopravno članstvo Europske Unije

2012   "Marie Curie uspješna priča", predstavljanje projekta između 23 odabrane individualne stipendije u publikaciji Europske komisije "EU FP7 People Specific Programme Success Stories Booklet"

2012   Godišnja nagrada ravnatelja Instituta Ruđer Bošković za 2012. godinu za rad u časopisu s visokim faktorom utjecaja

2010   "50.000-ti Marie Curie stipendist", nagrada Europske komisije dvadesetpetorici korisnika Marie Curie stipendije

2010   Godišnja nagrada ravnateljice Instituta Ruđer Bošković za 2010. godinu za projekt s visokim financiranjem

2010   Nagrada "Perspektivni znanstvenik" Centra za primjenjenu kvantnu mehaniku iz Pariza (Francuska)

2008   Godišnja nagrada Zaklade Hrvatske akademije znanosti i umjetnosti za 2008. godinu za razvijanje znanstvenoistraživačkog i umjetničkog rada

2007   Nagrada "Leopold Ružička" Hrvatskog kemijskog društva za 2006. godinu

2006   Državna nagrada za znanost za 2005. godinu znanstvenim novacima u području prirodnih znanosti; Ministarstvo znanosti, obrazovanja i športa i Sabor Republike Hrvatske

2004   Godišnja nagrada Društva sveučilišnih nastavnika i drugih znanstvenika u Zagrebu za znanstveni rad iz kemije na području prirodnih znanosti

2004   Stipendija zaklade Alexander von Humboldt za tromjesečni boravak na University of Heidelberg (Njemačka)

2004   Javno priznanje Grada Rijeke – Godišnja nagrada Grada Rijeke u 2004. godini za stvaralački rad i ostvarenja u području kemije tijekom 2002. i 2003. godine

1995   Nagrada za postignute rezultate u oblasti tehničke kulture i promociju grada Rijeke za 1995. godinu; Zajednica tehničke kulture i Grad Rijeka

1993–2000   Stipendist Grada Rijeke

1. R. Vianello, J. Mavri: "EVB simulation of the catalytic activity of monoamine oxidases: from chemical physics to neurodegeneration”, in Theory and applications of the empirical valence bond approach: from physical chemistry to chemical biology, (F. Duarte, S. C. L. Kamerlin, Eds.), John Wiley & Sons Ltd., Chichester, UK, 2017, p. 199–231.

2. A. Maršavelski, R. Vianello: "What a difference a methyl group makes: the selectivity of monoamine oxidase B towards histamine and N-methylhistamine", Chemistry – A European Journal 2017, 23, 2915–2925.

3. T. Gregorić, M. Sedić, P. Grbčić, A. Tomljenović Paravić, S. Kraljević Pavelić, M. Cetina, R. Vianello, S. Raić-Malić: "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 2017, 125, 1247–1267. 

4. M. Pavlin, M. Repič, R. Vianello, J. Mavri: "The chemistry of neurodegeneration: kinetic data and their implications”, Molecular Neurobiology 2016, 53, 3400–3415.  

5. D. Saftić, R. Vianello, B. Žinić: "5-Triazolyluracils and their N¹-sulfonyl derivatives: intriguing reactivity differences in the sulfonation of triazole N^1'-substituted and N^1'-unsubstituted uracil molecules", European Journal of Organic Chemistry 2015, 35, 7695–7704. 

6. I. Picek, R. Vianello, P. Šket, J. Plavec, B. Foretić: "Tandem β-elimination/hetero-Michael addition rearrangement of an N-alkylated pyridinium oxime to an O-alkylated pyridine oxime ether: an experimental and computational study", Journal of Organic Chemistry 2015, 80, 2165–2173.

7. I. Despotović, R. Vianello: "Engineering exceptionally strong oxygen superbases with 1,8-diazanaphthalene di-N-oxides”, Chemical Communications 2014, 50, 10941–10944. 

8. Z. B. Maksić, B. Kovačević, R. Vianello: "Advances in determining the absolute proton affinities of neutral organic molecules in the gas phase and their interpretation: a theoretical account", Chemical Reviews 2012, 112, 5240-5270.

9. R. Vianello, M. Repič, J. Mavri: "How are biogenic amines metabolized by monoamine oxidases?", European Journal of Organic Chemistry 2012, 7057–7065, rad na naslovnici.

10. R. Borštnar, M. Repič, M. Kržan, J. Mavri, R. Vianello: "Irreversible inhibition of monoamine ox­idase B by the antiparkinsonian medicines rasagiline and selegiline: a computational study", European Journal of Organic Chemistry 2011,  6419-6433, rad na naslovnici.

11. J. Stare, J. Mavri, J. Grdadolnik, J. Zidar, Z. B. Maksić, R. Vianello: "Hydrogen bond dynamics of histamine monocation in aqueous solution: Car-Parrinello molecular dynamics and vibrational spectroscopy study", Journal of Physical Chemistry B 2011, 115, 5999-6010.

12. R. Vianello, Z. B. Maksić: "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 2010, 22, 7670–7681.

Knjige i poglavlja u knjigama

Poglavlja u knjigama

• Horak, E., Vianello, R. & Murković Steinberg, I. (2019) Optical Sensing (Nano)Materials Based on Benzimidazole Derivatives. U: Marinescu, M. (ur.) Chemistry and Applications of Benzimidazole and its Derivatives. London : Delhi, IntechOpen, str. 184-205 doi:10.5772/intechopen.85643.

  doiwww.intechopen.com

• Vianello, R. & Mavri, J. (2017) EVB simulation of the catalytic activity of monoamine oxidases: from chemical physics to neurodegeneration. U: Duarte, F. & Kamerlin, S. (ur.) Theory and applications of the empirical valence bond approach: from physical chemistry to chemical biology. Chichester, John Wiley & Sons, str. 199-231 doi:10.1002/9781119245544.ch8.

  doi

Radovi u časopisima

Znanstveni i pregledni radovi

• Matić, J., Tandarić, T., Radić Stojković, M., Šupljika, F., Karačić, Z., Tomašić Paić, A., Horvat, L., Vianello, R. & Tumir, L. (2023) Phenanthridine–pyrene conjugates as fluorescent probes for DNA/RNA and an inactive mutant of dipeptidyl peptidase enzyme. Beilstein journal of organic chemistry, 19, 550-565 doi:10.3762/bjoc.19.40.

  doiwww.beilstein-journals.orgfulir.irb.hr

• Hok, L., Šakić, D., Vrček, V. & Vianello, R. (2023) Farmaceutski značaj procesa stereoizomerizacije. Kemija u industriji : časopis kemičara i tehnologa Hrvatske, (1-2), 55-64 doi:10.15255/kui.2022.027.

  doisilverstripe.fkit.hrsilverstripe.fkit.hrhrcak.srce.hrfulir.irb.hr

• Alizadeh, A., Bagherinejad, A., Kayanian, J. & Vianello, R. (2022) An expedient metal-free cascade route to chromonyl diene scaffolds: thermodynamic vs. kinetic control. RSC Advances, 12 (54), 34946-34950 doi:10.1039/d2ra05704b.

  doipubs.rsc.orgfulir.irb.hr

• Sakač, N., Madunić-Čačić, D., Marković , D., Hok, L., Vianello, R., Vrček, V., Šarkanj, B., Đurin, B., Della Ventura , B., Velotta, R. & Jozanović, M. (2022) Potentiometric Surfactant Sensor for Anionic Surfactants Based on 1,3-dioctadecyl-1H-imidazol-3-ium tetraphenylborate. Chemosensors, 10 (12), 523, 14 doi:10.3390/chemosensors10120523.

  doiwww.mdpi.com

• Pantalon Juraj, N., Tandarić, T., Tadić, V., Perić, B., Moreth, D., Schatzschneider, U., Brozovic, A., Vianello, R. & Kirin, S. (2022) Tuning the coordination properties of chiral pseudopeptide bis(2-picolyl)amine and iminodiacetamide ligands in Zn(II) and Cu(II) complexes. Dalton transactions, 51 (44), 17008-17021 doi:10.1039/d2dt02895f.

  doi

• Radović, M., Hok, L., Panić, M., Cvjetko Bubalo, M., Vianello, R., Vinković, M. & Radojčić Redovniković, I. (2022) Deep eutectic solvents as a stabilising medium for NAD coenzyme: unravelling the mechanism behind coenzyme stabilisation effect. Green chemistry, 24 (19), 7661-7674 doi:10.1039/d2gc02656b.

  doi

• Hok, L., Vianello, R., Matković- Čalogović, D., Karanović, L., Roca, S., Jaźwiński, J., Tašner, M., Vušak, D., Đaković, M. & Popović, Z. (2022) 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 (37), 6564-6578 doi:10.1039/d2ce00847e.

  doi

• Mehić, E., Hok, L., Wang, Q., Dokli, I., Svetec Miklenić, M., Findrik Blažević, Z., Tang, L., Vianello, R. & Majerić Elenkov, M. (2022) Expanding the scope of enantioselective halohydrin dehalogenases – group B. Advanced synthesis & catalysis, 364 (15), 2576-2588 doi:10.1002/adsc.202200342.

  doi

• Boček, I., Hok, L., Persoons, L., Daelemans, D., Vianello, R. & Hranjec, M. (2022) Imidazo[4,5-b]pyridine derived tubulin polymerization inhibitors: Design, synthesis, biological activity in vitro and computational analysis. Bioorganic chemistry, 127, 106032, 13 doi:10.1016/j.bioorg.2022.106032.

  doi

• Poje, G., Pessanha de Carvalho, L., Held, J., Moita, D., Prudêncio, M., Perković, I., Tandarić, T., Vianello, R. & Rajić, Z. (2022) Design and synthesis of harmiquins, harmine and chloroquine hybrids as potent antiplasmodial agents. European journal of medicinal chemistry, 238, 114408, 15 doi:10.1016/j.ejmech.2022.114408.

  doi

• Alizadeh, A., Bagherinejad, A., Kayanian, J. & Vianello, R. (2022) An experimental and computational study of new spiro-barbituric acid pyrazoline scaffolds: restricted rotation vs. annular tautomerism. New journal of chemistry, 46 (15), 7242-7252 doi:10.1039/d1nj06208e.

  doi

• Boček, I., Hranjec, M. & Vianello, R. (2022) 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, 118982, 12 doi:10.1016/j.molliq.2022.118982.

  doi

• Hok, L., Rimac, H., Mavri, J. & Vianello, R. (2022) 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, 1254-1263 doi:10.1016/j.csbj.2022.02.020.

  doiwww.sciencedirect.comfulir.irb.hr

• Maršavelski, A., Mavri, J., Vianello, R. & Stare, J. (2022) 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 (3), 1910, 15 doi:10.3390/ijms23031910.

  doiwww.mdpi.comdoi.orgfulir.irb.hr

• Camacho-Mojica, D., Ha, J., Min, S., Vianello, R. & Ruoff, R. (2022) Proton affinity and gas phase basicity of diamandoid molecules: diamantane to C131H116. PCCP. Physical chemistry chemical physics, 24, 3470-3477 doi:10.1039/d1cp04177k.

  doi

• Perin, N., Babić, D., Kassal, P., Čikoš, A., Hranjec, M. & Vianello, R. (2022) 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 (1), 21, 15 doi:10.3390/chemosensors10010021.

  doiwww.mdpi.comdx.doi.orgfulir.irb.hr

• Štefan, L., Čikoš, A., Vianello, R., Đilović, I., Matković-Čalogović, D. & Dumić, M. (2021) Chemistry of Spontaneous Alkylation of Methimazole with 1,2-Dichloroethane. Molecules, 26 (22), 7032, 21 doi:10.3390/molecules26227032.

  doiwww.mdpi.comfulir.irb.hrwww.mdpi.com

• Beč, A., Hok, L., Persoons, L., Vanstreels, E., Daelemans, D., Vianello, R. & Hranjec, M. (2021) Synthesis, computational analysis, and antiproliferative activity of novel benzimidazole acrylonitriles as tubulin polymerization inhibitors: Part 2. Pharmaceuticals, 14 (10), 1052, 26 doi:10.3390/ph14101052.

  doiwww.mdpi.comdx.doi.orgfulir.irb.hr

• Boček, I., Starčević, K., Novak Jovanović, I., Vianello, R. & Hranjec, M. (2021) Novel imidazo[4,5-b]pyridine derived acrylonitriles: A combined experimental and computational study of their antioxidative potential. Journal of molecular liquids, 342, 117527, 14 doi:10.1016/j.molliq.2021.117527.

  doi

• Marinović, M., Poje, G., Perković, I., Fontinha, D., Prudêncio, M., Held, J., Pessanha de Carvalho, L., Tandarić, T., Vianello, R. & Rajić, Z. (2021) 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, 113687, 20 doi:10.1016/j.ejmech.2021.113687.

  doi

• Sakač, N., Madunić-Čačić, D., Marković, D., Hok, L., Vianello, R., Šarkanj, B., Đurin, B., Hajdek, K., Smoljan, B., Milardović, S., Matasović, B. & Jozanović, M. (2021) 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 (12), 3627, 14 doi:10.3390/molecules26123627.

  doiwww.mdpi.comdx.doi.orgfulir.irb.hr

• Bistrović Popov, A., Vianello, R., Grbčić, P., Sedić, M., Kraljević Pavelić, S., Pavelić, K. & Raić-Malić, S. (2021) Novel bis- and mono-pyrrolo[2,3-d]pyrimidine and purine derivatives: Synthesis, computational analysis and antiproliferative evaluation. Molecules, 26 (11), 3334, 26 doi:10.3390/molecules26113334.

  doiwww.mdpi.comdx.doi.orgfulir.irb.hr

• Matić, J., Jukić, M., Ismaili, H., Saftić, D., Ban, Ž., Tandarić, T., Vianello, R., Opačak-Bernardi, T., Glavaš-Obrovac, L. & Žinić, B. (2021) 6-Morpholino- and 6-amino-9-sulfonylpurine derivatives. Synthesis, computational analysis, and biological activity. Nucleosides, nucleotides & nucleic acids, 40 (4), 470-503 doi:10.1080/15257770.2021.1896001.

  doi

• Hok, L., Lluch Sanchez, E., Vianello, R., Kukovec, B. & Popović, Z. (2021) 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 (15), 1470-1480 doi:10.1002/ejic.202100055.

  doi

• Ptiček, L., Hok, L., Grbčić, P., Topić, F., Cetina, M., Rissanen, K., Kraljević Pavelić, S., Vianello, R. & Racané, L. (2021) Amidino substituted 2-aminophenols: biologically important building blocks for the amidino-functionalization of 2-substituted benzoxazoles. Organic & biomolecular chemistry, 19, 2784-2793 doi:10.1039/d1ob00235j.

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• Hok, L. & Vianello, R. (2021) Direct Metal-Free Transformation of Alkynes to Nitriles: Computational Evidence for the Precise Reaction Mechanism. International journal of molecular sciences, 22 (6), 3193, 16 doi:10.3390/ijms22063193.

  doiwww.mdpi.comwww.mdpi.comdoi.orgfulir.irb.hr

• Perin, N., Hok, L., Beč, A., Persoons, L., Vanstreels, E., Daelemans, D., Vianello, R. & Hranjec, M. (2021) N-substituted benzimidazole acrylonitriles as in vitro tubulin polymerization inhibitors: Synthesis, biological activity and computational analysis. European journal of medicinal chemistry, 211, 113003, 14 doi:10.1016/j.ejmech.2020.113003.

  doi

• Prah, A., Purg, M., Stare, J., Vianello, R. & Mavri, J. (2020) 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 (38), 8259-8265 doi:10.1021/acs.jpcb.0c06502.

  doipubs.acs.orgfulir.irb.hr

• Hok, L., Mavri, J. & Vianello, R. (2020) The Effect of Deuteration on the H2 Receptor Histamine Binding Profile: A Computational Insight into Modified Hydrogen Bonding Interactions. Molecules, 25 (24), 6017, 17 doi:10.3390/molecules25246017.

  doiwww.mdpi.comdoi.orgfulir.irb.hr

• Rowlands, G., Severinsen, R., Buchanan, J., Shaffer, K., Jameson, H., Thennakoon, N., Leito, I., Lõkov, M., Kütt, A., Vianello, R., Despotović, I., Radić, N. & Plieger, P. (2020) Synthesis and Basicity Studies of Quinolino[7,8‑h]quinoline Derivatives. Journal of organic chemistry, 85, 11297-11308 doi:10.1021/acs.joc.0c01428.

  doi

• Roca, S., Hok, L., Vianello, R., Borovina, M., Đaković, M., Karanović, L., Vikić-Topić, D. & Popović, Z. (2020) The role of non-covalent intermolecularinteractions on the diversity of crystal packing insupramolecular dihalopyridine–silver(I) nitratecomplexes. Crystengcomm, 22, 7962-7974 doi:10.1039/d0ce01257b.

  doi

• Marinović, M., Perković, I., Fontinha, D., Prudêncio, M., Held, J., Pessanha de Carvalho, L., Tandarić, T., Vianello, R., Zorc, B. & Rajić, Z. (2020) Novel Harmicines with Improved Potency against Plasmodium. Molecules, 25 (19), 4376, 19 doi:10.3390/molecules25194376.

  doiwww.mdpi.comfulir.irb.hr

• Tandarić, T., Prah, A., Stare, J., Mavri, J. & Vianello, R. (2020) 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 (17), 6151, 13 doi:10.3390/ijms21176151.

  doifulir.irb.hrwww.mdpi.com

• Rimac, H., Tandarić, T., Vianello, R. & Bojić, M. (2020) Indomethacin increases quercetin affinity for human serum albumin: a combined experimental and computational study and its broader implications. International journal of molecular sciences, 21 (16), 5740, 14 doi:10.3390/ijms21165740.

  doiwww.mdpi.comdoi.orgfulir.irb.hr

• Pantalon Juraj, N., Krklec, M., Novosel, T., Perić, B., Vianello, R., Raić-Malić, S. & Kirin, S. (2020) Copper(II) and zinc(II) complexes of mono- and bis-1,2,3-triazole substituted heterocyclic ligands. Dalton transactions, 49 (26), 9002-9015 doi:10.1039/d0dt01244k.

  doi

• Foretić, B., Damjanović, V., Vianello, R. & Picek, I. (2020) Novel insights into the thioesterolytic activity of N-substituted pyridinium-4-oximes. Molecules, 25 (10), 2385, 16 doi:10.3390/molecules25102385.

  doi

• Valadbeigi, Y. & Vianello, R. (2020) Is It Possible to Achieve Organic Superbases beyond the Basicity Limit Using Tetrahedrane Scaffolds?. ChemistrySelect, 5 (19), 5794-5798 doi:10.1002/slct.202001407.

  doi

• Pregeljc, D., Teodorescu-Perijoc, D., Vianello, R., Umek, N. & Mavri, J. (2020) How Important Is the Use of Cocaine and Amphetamines in the Development of Parkinson Disease? A Computational Study. Neurotoxicity research, 37, 724-731 doi:10.1007/s12640-019-00149-0.

  doi

• Pantalon Juraj, N., Muratović, S., Perić, B., Šijaković Vujičić, N., Vianello, R., Žilić, D., Jagličić, Z. & Kirin, S. (2020) Structural variety of isopropyl-bis(2-picolyl)amine complexes with zinc(II) and copper(II). Crystal growth & design, 20 (4), 2440-2453 doi:10.1021/acs.cgd.9b01625.

  doi

• Kržan, M., Keuschler, J., Mavri, J. & Vianello, R. (2020) Relevance of Hydrogen Bonds for the Histamine H2 Receptor-Ligand Interactions: A Lesson from Deuteration. Biomolecules, 10 (2), 196, 10 doi:10.3390/biom10020196.

  doiwww.mdpi.comwww.mdpi.comdoi.orgfulir.irb.hr

• Perković, I., Raić-Malić, S., Fontinha, D., Prudêncio, M., Pessanha de Carvalho, L., Held, J., Tandarić, T., Vianello, R., Zorc, B. & Rajić, Z. (2020) Harmicines − harmine and cinnamic acid hybrids as novel antiplasmodial hits. European journal of medicinal chemistry, 187, 111927, 16 doi:10.1016/j.ejmech.2019.111927.

  doi

• Horak, E., Babić, D., Vianello, R., Perin, N., Hranjec, M. & Murković Steinberg, I. (2020) 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, 117588, 15 doi:10.1016/j.saa.2019.117588.

  doi

• Pantalon Juraj, N., Miletić, G., Perić, B., Popović, Z., Smrečki, N., Vianello, R. & Kirin, S. (2019) Stereochemistry of Hexacoordinated Zn(II), Cu(II), Ni(II), and Co(II) Complexes with Iminodiacetamide Ligands. Inorganic chemistry, 58 (24), 16445-16457 doi:10.1021/acs.inorgchem.9b02200.

  doi

• Tandarić, T., Hok, L. & Vianello, R. (2019) From Hydrogen Peroxide-Responsive Boronated Nucleosides Towards Antisense Therapeutics – A Computational Mechanistic Study. Croatica chemica acta, 92 (2), 287-295 doi:10.5562/cca3592.

  doihrcak.srce.hrdoi.orgfulir.irb.hr

• Valadbeigi, Y. & Vianello, R. (2019) 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 (10), e3995, 10 doi:10.1002/poc.3995.

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• Tshepelevitsh, S., Kütt, A., Lõkov, M., Kaljurand, I., Saame, J., Heering, A., Plieger, P., Vianello, R. & Leito, I. (2019) On the Basicity of Organic Bases in Different Media. European journal of organic chemistry, 2019 (40), 6735-6748 doi:10.1002/ejoc.201900956.

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• Cindrić, M., Sović, I., Mioč, M., Hok, L., Boček, I., Roškarić, P., Butković, K., Martin-Kleiner, I., Starčević, K., Vianello, R., Kralj, M. & Hranjec, M. (2019) Experimental and computational study of the antioxidative potential of novel nitro and amino substituted benzimidazole/benzothiazole-2-carboxamides with antiproliferative activity. Antioxidants, 8 (10), 477, 22 doi:10.3390/antiox8100477.

  doidx.doi.orgwww.mdpi.comfulir.irb.hr

• Toma, M., Božičević, L., Lapić, J., Djaković, S., Šakić, D., Tandarić, T., Vianello, R. & Vrček, V. (2019) Transacylation in Ferrocenoyl-Purines. NMR and Computational Study of the Isomerization Mechanism. Journal of organic chemistry, 84 (19), 12471-12480 doi:10.1021/acs.joc.9b01944.

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• Tandarić, T. & Vianello, R. (2019) 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 (8), 3532-3542 doi:10.1021/acschemneuro.9b00147.

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• Matić, J., Šupljika, F., Tandarić, T., Dukši, M., Piotrowski, P., Vianello, R., Brozović, A., Piantanida, I., Schmuck, C. & Radić Stojković, M. (2019) DNA/RNA recognition controlled by the glycine linker and the guanidine moiety of phenanthridine peptides. International journal of biological macromolecules, 134, 422-434 doi:10.1016/j.ijbiomac.2019.05.063.

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• Horak, E., Robić, M., Šimanović, A., Mandić, V., Vianello, R., Hranjec, M. & Murković Steinberg, I. (2019) Tuneable solid-state emitters based on benzimidazole derivatives: aggregation induced red emission and mechanochromism of D-π-A fluorophores. Dyes and pigments, 162, 688-696 doi:10.1016/j.dyepig.2018.10.069.

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• Valadbeigi, Y. & Vianello, R. (2018) 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 (21), e25754, 10 doi:10.1002/qua.25754.

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• Foretić, B., Vianello, R., Matković-Čalogović, D., Jadreško, D. & Picek, I. (2018) Supramolecular inter-ionic charge-transfer complexes between derivatives of pyridinium-4-oxime cations and hexacyanoferrate(II) anions. New journal of chemistry, 42, 16115-16126 doi:10.1039/c8nj03066a.

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• Perin, N., Roškarić, P., Sović, I., Boček, I., Starčević, K., Hranjec, M. & Vianello, R. (2018) Amino-substituted benzamide derivatives as promising antioxidant agents: a combined experimental and computational study. Chemical research in toxicology, 31 (9), 974-984 doi:10.1021/acs.chemrestox.8b00175.

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• Maršavelski, A., Petrović, D., Bauer, P., Vianello, R. & Kamerlin, S. (2018) Empirical Valence Bond Simulations Suggest a Direct Hydride Transfer Mechanism for Human Diamine Oxidase. ACS Omega, 3 (4), 3665-3674 doi:10.1021/acsomega.8b00346.

  doipubs.acs.orgfulir.irb.hrpubs.acs.org

• Tandarić, T. & Vianello, R. (2018) 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 (5), 1464-1471 doi:10.1021/acs.jpca.7b11945.

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• Dabić, D., Brkljačić, L., Tandarić, T., Žinić, M., Vianello, R., Frkanec, L. & Kobetić, R. (2018) 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 (1), 103-113 doi:10.1007/s13361-017-1834-5.

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• Horak, E., Vianello, R., Hranjec, M. & Murković Steinberg, I. (2018) Colourimetric and fluorimetric metal ion chemosensor based on a benzimidazole functionalised Schiff base. Supramolecular chemistry, 30 (10), 891-900 doi:10.1080/10610278.2018.1436708.

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• Hranjec, M., Horak, E., Babić, D., Plavljanin, S., Srdović, Z., Murković Steinberg, I., Vianello, R. & Perin, N. (2017) Fluorescent benzimidazo[1,2-a]quinolines: synthesis, spectroscopic and computational studies of protonation equilibria and metal ion sensitivity. New journal of chemistry, 41 (1), 358-371 doi:10.1039/c6nj02268e.

  doipubs.rsc.orgdx.doi.orgfulir.irb.hr

• Oanca, G., Stare, J., Vianello, R. & Mavri, J. (2017) Multiscale simulation of monoamine oxidase catalyzed decomposition of phenylethylamine analogs. European journal of pharmacology, 817, 46-50 doi:10.1016/j.ejphar.2017.05.061.

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• Ban, Ž., Žinić, B., Vianello, R., Schmuck, C. & Piantanida, I. (2017) Nucleobase–Guanidiniocarbonyl-Pyrrole Conjugates as Novel Fluorimetric Sensors for Single Stranded RNA. Molecules, 22 (12), 2213, 22 doi:10.3390/molecules22122213.

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• Jug, U., Pregeljc, D., Mavri, J., Vianello, R. & Stare, J. (2017) 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, 96-101 doi:10.1016/j.comptc.2017.02.003.

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• Lõkov, M., Tshepelevitsh, S., Heering, A., Plieger, P., Vianello, R. & Leito, I. (2017) On the Basicity of Conjugated Nitrogen Heterocycles in Different Media. European journal of organic chemistry, 2017 (30), 4475-4489 doi:10.1002/ejoc.201700749.

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• Leščić Ašler, I., Štefanić, Z., Maršavelski, A., Vianello, R. & Kojić-Prodić, B. (2017) 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 (7), 1928-1936 doi:10.1021/acschembio.6b01140.

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• Maršavelski, A. & Vianello, R. (2017) What a difference a methyl group makes - the selectivity of monoamine oxidase B towards histamine and N-methylhistamine. Chemistry : a European journal, 23 (12), 2915-2925 doi:10.1002/chem.201605430.

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• Horak, E., Hranjec, M., Vianello, R. & Murković Steinberg, I. (2017) Reversible pH switchable aggregation-induced emission of self-assembled benzimidazole-based acrylonitrile dye in aqueous solution. Dyes and pigments, 142, 108-115 doi:10.1016/j.dyepig.2017.03.021.

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• Horak, E., Vianello, R., Hranjec, M., Krištafor, S., Karminski Zamola, G. & Murković Steinberg, I. (2017) 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, 225-233 doi:10.1016/j.saa.2017.02.011.

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• Gregorić, T., Sedić, M., Grbčić, P., Tomljenović Paravić, A., Kraljević Pavelić, S., Cetina, M., Vianello, R. & Raić-Malić, S. (2017) 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, 1247-1267 doi:10.1016/j.ejmech.2016.11.028.

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• Poberžnik, M., Purg, M., Repič, M., Mavri, J. & Vianello, R. (2016) 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 (44), 11419-11427 doi:10.1021/acs.jpcb.6b09011.

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• Vianello, R., Domene, C. & Mavri, J. (2016) 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, 327, 24 doi:10.3389/fnins.2016.00327.

  doifulir.irb.hrjournal.frontiersin.org

• Pavlin, M., Repič, M., Vianello, R. & Mavri, J. (2016) The Chemistry of Neurodegeneration: Kinetic Data and Their Implications. Molecular neurobiology, 53, 3400-3415 doi:10.1007/s12035-015-9284-1.

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• Schwamm, R., Vianello, R., Maršavelski, A., García, M., Claramunt, R., Alkorta, I., Saame, J., Leito, I., Fitchett, C., Edwards, A. & Coles, M. (2016) 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 (17), 7612-7625 doi:10.1021/acs.joc.6b01330.

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• Kržan, M., Vianello, R., Maršavelski, A., Repič, M., Zakšek, M., Kotnik, K., Fijan, E. & Mavri, J. (2016) The Quantum Nature of Drug-Receptor Interactions: Deuteration Changes Binding Affinities for Histamine Receptor Ligands. PLoS One, 11, e0154002-e0154002 doi:10.1371/journal.pone.0154002.

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• Mavri, J., Matute, R., Chu, Z. & Vianello, R. (2016) 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 (14), 3488-3492 doi:10.1021/acs.jpcb.6b00894.

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• Škalamera, Đ., Sanders, E., Vianello, R., Maršavelski, A., Pevec, A., Turel, I. & Kirin, S. (2016) Synthesis and characterization of ML and ML2 metal complexes with amino acid substituted bis(2-picolyl)amine ligands. Dalton transactions, 45 (7), 2845-2858 doi:10.1039/C5DT03387J.

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• Maršavelski, A., Smrečki, V., Vianello, R., Žinić, M., Moguš-Milanković, A. & Šantić, A. (2015) Supramolecular Ionic-Liquid Gels with High Ionic Conductivity. Chemistry : a European journal, 21 (34), 12121-12128 doi:10.1002/chem.201500887.

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• Saftić, D., Vianello, R. & Žinić, B. (2015) 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, 7695-7704 doi:10.1002/ejoc.201501088.

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• Maršavelski, A., Močibob, M., Gruić- Sovulj, I. & Vianello, R. (2015) The origin of specificity and insight into recognition between an aminoacyl carrier protein and its partner ligase. Physical Chemistry Chemical Physics, 17 (29), 19030-19038 doi:10.1039/C5CP03066H.

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• Picek, I., Vianello, R., Šket, P., Plavec, J. & Foretić, B. (2015) 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 (4), 2165-2173 doi:10.1021/jo5026755.

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• Pirc, G., Stare, J., Mavri, J. & Vianello, R. (2014) Hydrogen bond dynamics of histamine monocation in aqueous solution: how geometric arameters influence the hydrogen bond strength. Croatica chemica acta, 87 (4), 397-405 doi:10.5562/cca2512.

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• Repič, M., Vianello, R., Purg, M., Duarte, F., Bauer, P., Kamerlin, S. & Mavri, J. (2014) Empirical valence bond simulations of the hydride transfer step in the monoamine oxidase B catalyzed metabolism of dopamine. Proteins, 82 (12), 3347-3355 doi:10.1002/prot.24690.

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• Despotović, I. & Vianello, R. (2014) Engineering exceptionally strong oxygen superbases with 1, 8-diazanaphthalene di-N-oxides. Chemical communications, 50 (75), 10941-10944 doi:10.1039/C4CC05125D.

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• Curpan, R., Avram, S., Vianello, R. & Bologa, C. (2014) Exploring the biological promiscuity of high- throughput screening hits through DFT calculations. Bioorganic & medicinal chemistry, 22 (8), 2461-2461 doi:10.1016/j.bmc.2014.02.055.

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• Repič, M., Purg, M., Vianello, R. & Mavri, J. (2014) 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 (16), 4326-4332 doi:10.1021/jp500795p.

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• Pavlin, M., Mavri, J., Repič, M. & Vianello, R. (2013) Quantum-chemical approach to determining the high potency of clorgyline as an irreversible acetylenic monoamine oxidase inhibitor. Journal of neural transmission, 120 (6), 875-882 doi:10.1007/s00702-013-1016-y.

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• Glušič, M., Stare, J., Grdadolnik, J. & Vianello, R. (2013) Binding of cadmium dication to glutathione facilitates cysteine -SH deprotonation: A computational DFT study. Journal of inorganic biochemistry, 119, 90-94 doi:10.1016/j.jinorgbio.2012.11.004.

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• Radić, N., Despotović, I. & Vianello, R. (2012) Ring Strain and Other Factors Governing the Basicity of Nitrogen Heterocycles - An Interpretation by Triadic Analysis. Croatica chemica acta, 85 (4), 495-504 doi:10.5562/cca2121.

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• Vianello, R., Repič, M. & Mavri, J. (2012) How are Biogenic Amines Metabolized by Monoamine Oxidases?. European journal of organic chemistry, 2012 (36), 7057-7065 doi:10.1002/ejoc.201201122.

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• Maksić, Z., Kovačević, B. & Vianello, R. (2012) Advances in Determining the Absolute Proton Affinities of Neutral Organic Molecules in the Gas Phase and Their Interpretation : A Theoretical Account. Chemical reviews, 112 (10), 5240-5270 doi:10.1021/cr100458v.

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• Borštnar, R., Repič, M., Kamerlin, S., Vianello, R. & Mavri, J. (2012) 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 (10), 3864-3870 doi:10.1021/ct300119u.

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• Vianello, R. & Mavri, J. (2012) Microsolvation of the histamine monocation in aqueous solution : the effect on structure, hydrogen bonding ability and vibrational spectrum. New journal of chemistry, 36, 954-962 doi:10.1039/C2NJ20877F.

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• Borštnar, R., Repič, M., Kržan, M., Mavri, J. & Vianello, R. (2011) Irreversible Inhibition of Monoamine Ox­idase B by the Antiparkinsonian Medicines Rasagiline and Selegiline: A Computational Study. European journal of organic chemistry, 2011 (32), 6419-6433 doi:10.1002/ejoc.201100873.

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• Vianello, R. (2011) Protonation of Azines and Purines as a Model for the Electrophilic Aromatic Substitution – Rationalization by Triadic Formula. Acta chimica Slovenica, 58 (3), 509-520.

• Stare, J., Mavri, J., Grdadolnik, J., Zidar, J., Maksić, Z. & Vianello, R. (2011) 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 (19), 5999-6010 doi:10.1021/jp111175e.

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• Vianello, R. & Maksić, Z. (2010) 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 (22), 7670-7681 doi:10.1021/jo101581a.

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• Coles, M., Aragon-Saez, P., Oakley, S., Hitchcock, P., Davidson, M., Maksić, Z., Vianello, R., Leito, I., Kaljurand, I. & Apperley, D. (2009) Superbasicity of a Bis-guanidino Compound with a Flexible Linker : A Theoretical and Experimental Study. Journal of the American Chemical Society, 131 (46), 16858-16868 doi:10.1021/ja906618g.

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• Vianello, R. (2009) Acidifying Effect of an N-Oxide Group - A Useful Motif in Enhancing Acidity towards Superacidic Values. Croatica Chemica Acta, 82 (1), 27-39.

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• Vianello, R. & Maksić, Z. (2009) The engineering of powerful non-ionic superacids in silico - a DFT-B3LYP study of open chain polycyanopolyenes. New Journal of Chemistry, 33 (4), 739-748 doi:10.1039/b816922e.

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• Vianello, R. & Maksić, Z. (2008) 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 (3), 413-427 doi:10.1039/B713173A.

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• Vianello, R. & Maksić, Z. (2007) Interpretation of Broensted Acidity by Triadic Paradigm: A G3 Study of Mineral Acids. Journal of Physical Chemistry A, 111 (45), 11718-11724.

• Vianello, R. & Maksić, Z. (2007) Aromaticity of Rees-type Hydrocarbons - a DFT Computational Study. Structural Chemistry, 18 (6), 821-826.

• Despotović, I., Maksić, Z. & Vianello, R. (2007) 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 (20), 3402-3413.

• Maksić, Z. & Vianello, R. (2007) The Physical Origin of Chemical Phenomena - Interpretation of Acidity, Basicity and Hydride Affinity by Trichotomy Paradigm. Pure and Applied Chemistry, 79 (6), 1003-1021.

• Despotović, I., Maksić, Z. & Vianello, R. (2007) Computational design of Bronsted neutral organic superbases - [3]iminoradialenes and quinonimines are important synthetic targets. New Journal of Chemistry, 31, 52-62.

• Vianello, R., Peran, N. & Maksić, Z. (2007) Hydride Affinities of Substituted Alkenes: Their Prediction by Density Functional Calculations and Rationalisation by Triadic Formula. European Journal of Organic Chemistry, 4, 526-539.

• Despotović, I., Maksić, Z. & Vianello, R. (2006) Engineering Neutral Organic Bases and Superbases by Computational DFT Methods - Carbonyl Polyenes. European Journal of Organic Chemistry, 24, 5505-5514.

• Vianello, R., Peran, N. & Maksić, Z. (2006) Hydride Affinities of some Substituted Alkynes - Prediction by DFT Calculations and Rationalization by Triadic Formula. The Journal of Physical Chemistry A, 110 (47), 12870-12881.

• Vianello, R., Maskill, H. & Maksić, Z. (2006) 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, 2581-2589.

• Vianello, R. & Maksić, Z. (2006) Triadic analysis of substituent effects - gas-phase acidity of para-substituted phenols. Tetrahedron, 62, 3402-3411.

• Vianello, R. & Maksić, Z. (2005) Towards highly powerful neutral organic superacids - a DFT study of some polycyano derivatives of planar hydrocarbons. Tetrahedron, 61 (39), 9381-9390.

• Vianello, R. & Maksić, Z. (2005) Extremal Acidity of Rees Polycyanated Hydrocarbons in the Gas Phase and DMSO - a Density Functional Study. Chemical communications, 27, 3412-3414.

• Vianello, R. & Maksić, Z. (2005) 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, 3571-3580.

• Vianello, R. & Maksić, Z. (2005) High acidity of polycyano azatriquinanes - theoretical prediction by the DFT calculations. Tetrahedron letters, 46, 3711-3713.

• Vianello, R. & Maksić, Z. (2005) Hydride Affinities of Borane Derivatives: Novel Approach in Determining the Origin of Lewis Acidity Based on Triadic Formula. Inorganic Chemistry, 44, 1095-1102.

• Vianello, R. & Maksić, Z. (2005) Gas-phase acidity of para-substituted benzoic acids - a triadic analysis of substituent effects. Journal of physical organic chemistry, 18, 699-705.

• Vianello, R. & Maksić, Z. (2005) Acidities of Azoles in the Gas Phase and in DMSO - An Ab Initio and DFT Study. Molecular physics, 103, 209-219.

• Vianello, R., Kovačević, B., Ambrožić, G., Mavri, J. & Maksić, Z. (2004) Hydrogen bonding in complex of serine with histidine : computational and spectroscopic study of model compounds. Chemical physics letters, 400 (1-3), 117-121 doi:10.1016/j.cplett.2004.10.089.

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• Maksić, Z. & Vianello, R. (2004) Extending Acidity Ladder of Neutral Organic Superacids - A DFT-B3LYP Study of Deprotonation of Nonacyanofluorene. Tetrahedron letters, 45, 8663-8666.

• Vianello, R. & Maksić, Z. (2004) Acidity of Bronsted CH Acids in DMSO - The Extreme Acidity of Nonacyanocyclononatetraene. European journal of organic chemistry, 24, 5003-5010.

• Vianello, R., Liebman, J. & Maksić, Z. (2004) In Search of Ultrastrong Bronsted Neutral Organic Superacids - A DFT Study of some Cyclopentadiene Derivatives. Chemistry-A European Journal, 10, 5751-5761.

• Maksić, Z. & Vianello, R. (2004) Design of Strong Neutral Organic Superacids: DFT-B3LYP Calculations on some Isobenzofulvene Derivatives. European Journal of Organic Chemistry, 9, 1940-1945.

• Maksić, Z. & Vianello, R. (2004) Tailoring of Strong Neutral Organic Superacids: DFT-B3LYP Calculations on some Fulvene Derivatives. New journal of chemistry, 28, 843-846.

• Barić, D., Maksić, Z. & Vianello, R. (2004) On the Atomic Additivity of the Zero Point Vibrational Energy in Molecules. Journal of molecular structure. Theochem, 1-3 (672), 201-207.

• Vianello, R. & Maksić, Z. (2003) A Combined Ab Initio and Density Functional Study of the Electronic Structure of Thymine and 2-Thiothymine Radicals. Collection of Czechoslovak chemical communications, 68 (12), 2322-2334.

• Kovačević, B., Maksić, Z., Vianello, R. & Primorac, M. (2002) Computer Aided Design of Organic Superbases - The Role of Intramolecular Hydrogen Bonding. New Journal of Chemistry, 26, 1329-1334.

• Maksić, Z. & Vianello, R. (2002) 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, 6515-6520.

• Vianello, R., Kovačević, B. & Maksić, Z. (2002) In Search for Neutral Organic Superbases - Iminopolyenes and Their Amino Derivatives. New Journal of Chemistry, 26, 1324-1328.

• Maksić, Z. & Vianello, R. (2002) Anionic vs. Neutral Protonation - An Ab Initio Analysis with a Triadic Formula. ChemPhysChem, 3 (8), 696-700.

• Maksić, Z. & Vianello, R. (2002) Quest for the Origin of Basicity: Initial vs. Final State Effect in Neutral Nitrogen Bases. Journal of Physical Chemistry A, 106, 419-430.

• Kovačević, B., Maksić, Z. & Vianello, R. (2001) The Proton Affinity of Some Extended pi-Systems Involving Guanidine and Cyclopropenimine Subunits. Journal of the Chemical Society. Perkin Transactions 2, - (-), 886-891 doi:10.1039/B101213O.

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Ocjenski radovi

Doktorske disertacije

• Vianello, R. (2003) 'Interakcije Lewisovih kiselina i baza', doktorska disertacija, Prirodoslovno-matematički fakultet, Zagreb.

nacionalni predstavnik u International Society of Theoretical Chemistry and Physics (od 2013.)

član Hrvatskog kemijskog društva (od 2001.)

član Hrvatskog društva kemijskih inženjera i tehnologa (od 2006.)

član Hrvatskog društva za teorijsku i matematičku biologiju (od 2003.)