Ph.D.: 1997,  Chemistry, Theoretical and physical chemistry, Faculty of Science, University of Zagreb, Croatia

M.Sc.: 1994, Physics, Molecular biophysics, Faculty of Science, University of Zagreb, Croatia

B.Sc.: 1989, Electronics, Faculty of Electrical Engineering and Computing, University of Zagreb, Croatia

Secondary School: 1983, Gymnasium, Gradačac, Bosnia and Herzegovina

  Development and application of improved chemoinformatics methods in the biosciences, CRO-GER project (DAAD) (2021-2022), project leader from the Croatian side

 Bioprospecting of Adriatic See, Croatian Government and the European Union through the European Regional Development Fund - the Competitiveness and Cohesion Operational Programme (KK.01.1.1.01) – The Scientific Centre of Excellence for Marine Bioprospecting -BioProCro granted to Rozelinda Čož-Rakovac, (2017-), associate/researcher

  Investigation of chemism and antioxidant activity of complexes of polyphenols with essential metals, CRO-SRB project (2016-2017), Ministry of Science Education and Sports of the Republic of Croatia, researcher from the Croatian side

  Developing methods for modeling properties of bioactive molecules and proteins (2012-2014), project leader, Ministry of Science, Education and Sports of the Republic of Croatia

  Investigation of relationships between structure and biological activity of polyphenols, CRO-SRB project (2011-2012), project leader from the Croatian side, Ministry of Science Education and Sports of the Republic of Croatia

  Developing methods for modeling properties of bioactive molecules and proteins (2007-2011), associate/researcher, Ministry of Science Education and Sports of the Republic of Croatia, researcher

  Development and application of models in chemistry and bioinformatics (2002-2006), associate/researcher, Ministry of Science Education and Sports of the Republic of Croatia

  Toxicity and carcinogenicity of organic molecules on living organisms in the environment, HR-SLO project (2001-2003), project leader from the Croatian side, Ministry of Science Education and Sports of the Republic of Croatia

  IQ QSAR program (2001-2004), project co-leader, PLIVA, Zagreb

  Predicting structure of proteins and bio-active molecules (1998-2001), project leader, Ministry of Science Education and Sports of the Republic of Croatia

  Development and application of models in chemistry (1996-2002), associate/researcher, Ministry of Science Education and Sports of the Republic of Croatia

  Development and application of models in chemistry (1992-1996), associate/researcher, Ministry of Science Education and Sports of the Republic of Croatia

  Predicting structure and activity of membrane polypeptides (1991-1992), associate/researcher, Ministry of Science Education and Sports of the Republic of Croatia

2022, Associate Professor (honorary position) at the J. J. Strossmayer University in Osijek, Osijek, Croatia

Structural bioinformatics of proteins and bioactive molecules, PhD Study of Molecular Biosciences (2008-) (organized by: University of Osijek, Ruđer Bošković Institute and University of Dubrovnik)

Models and methods in structural bioinformatics, PhD Study of Biophysics (2009-) (organized by: University of Split, Ruđer Bošković Institute (Zagreb), Institute of Physics (Zagreb),  and Mediterranean Institute for Life Sciences (Split))

Member of the Council of PhD study Biophysics (2009-2018), University of Split, Croatia

Mentorships

Two PhD Dissertations - at the University of Zagreb, Croatia (in theoretical chemistry) and at the University of Split, Croatia (in biophysics)

One M.Sc. Thesis at the University of Zagreb, Croatia (technical sciences)

Three B.Sc. Thesis at the University of Zagreb, Croatia - at the Faculty of Science (one in physics/biophysics and another one in chemistry) and at the Faculty of Pharmacy and Biochemistry (in pharmacy)

Lovrić, Mario; Malev, Olga; Klobučar, Goran; Kern, Roman; Liu, Jay; Lučić, Bono, Predictive Capability of QSAR Models Based on the CompTox Zebrafish Embryo Assays: An Imbalanced Classification Problem. // Molecules, 26 (2021), 6; 1617, 15 doi:10.3390/molecules26061617

Cichońska, Anna; Ravikumar, Balaguru; Allaway, Robert J.; Wan, Fangping; Park, Sungjoon; Isayev, Olexandr; Li, Shuya; Mason, Michael; Lamb, Andrew; Tanoli, Ziaurrehman et al., Crowdsourced mapping of unexplored target space of kinase inhibitors. // Nature communications, 12 (2021), 3307, 18 doi:10.1038/s41467-021-23165-1

Lovrić, Mario; Pavlović, Kristina; Žuvela, Petar; Spataru, Adrian; Lučić, Bono; Kern, Roman; Wong, Ming Wah, Machine learning in prediction of intrinsic aqueous solubility of drug‐like compounds: Generalization, complexity, or predictive ability?. // Journal of chemometrics, 35 (2021), 7-8; e3349, 16 doi:10.1002/cem.3349

Lučić, Bono; Batista, Jadranko; Bojović, Viktor; Lovrić, Mario; Sović Kržić, Ana; Bešlo, Drago; Nadramija, Damir; Vikić-Topić, Dražen, Estimation of Random Accuracy and its Use in Validation of Predictive Quality of Classification Models within Predictive Challenges // Croatica Chemica Acta, 92 (2019), 3; 226865, 13 doi:10.5562/cca3551

Amić, Ana; Marković, Zoran; Dimitrić Marković, Jasmina M., Milenković, Dejan; Lučić, Bono, The role of guaiacyl moiety in free radical scavenging by 3, 5-dihydroxy-4-methoxybenzyl alcohol: Thermodynamics of 3H+/3e- mechanisms // Molecular physics, 117 (2019), 2; 207-217 doi:10.1080/00268976.2018.1508777

Amić, Ana; Lučić, Bono; Stepanić, Višnja; Marković, Zoran; Marković, Svetlana; Dimitrić Marković, Jasmina; Amić, Dragan, Free radical scavenging potency of quercetin catecholic colonic metabolites: thermodynamics of 2H+/2e- processes // Food chemistry, 218 (2017), 144-151 doi:10.1016/j.foodchem.2016.09.018

Batista, Jadranko; Vikić-Topić, Dražen; Lučić, Bono, The difference between the accuracy of real and the corresponding random model is a useful parameter for validation of two-state classification model quality // Croatica chemica acta, 89 (2016), 4; 527-534 doi:10.5562/cca3117

Filipović, Miloš; Marković, Zoran; Đorović, Jelena; Dimitrić Marković, Jasmina; Lučić, Bono; Amić, Dragan, QSAR of the free radical scavenging potency of selected hydroxybenzoic acids and simple phenolics // Comptes rendus. Chimie, 18 (2015), 5; 492-498 doi:10.1016/j.crci.2014.09.001

Amić, Ana; Marković, Zoran; Dimitrić Marković, Jasmina; Stepanić, Višnja; Lučić, Bono; Amić, Dragan, Towards an improved prediction of the free radical scavenging potency of flavonoids: The significance of double PCET mechanisms // Food chemistry, 152 (2014), 578-585 doi:10.1016/j.foodchem.2013.12.025

Lučić, Bono; Stepanić, Višnja; Plavšić, Dejan; Amić, Ana; Amić, Dragan, Correlation between 13C NMR chemical shifts and antiradical activity of flavonoids // Monatshefte für Chemie, 145 (2014), 3; 457-463 doi:10.1007/s00706-013-1130-4

Stepanić, Višnja; Gall Trošelj, Koraljka; Lučić, Bono; Marković, Zoran; Amić, Dragan, Bond dissociation free energy as a general parameter for flavonoid radical scavenging activity // Food chemistry, 141 (2013), 2; 1562-1570 doi:10.1016/j.foodchem.2013.03.072,

Tanabe, Kazutoshi; Kurita, Takio; Nishida, Kenji; Lučić, Bono; Amić, Dragan; Suzuki, Takahiro, Improvement of carcinogenicity prediction performances based on sensitivity analysis in variable selection of SVM models // SAR and QSAR in environmental research, 24 (2013), 7; 565-580

Lučić, Bono; Sović, Ivan; Batista, Jadranko; Skala, Karolj; Plavšić, Dejan; Vikić-Topić, Dražen; Bešlo, Drago; Nikolić, Sonja; Trinajstić, Nenad, The Sum-Connectivity Index - An Additive Variant of the Randić Connectivity Index // Current computer-aided drug design, 9 (2013), 2; 184-194 doi:10.2174/1573409911309020004

Marković, Zoran; Milenković, Dejan; Đorović, Jelena; Dimitrić Marković, Jasmina; Stepanić, Višnja; Lučić, Bono; Amić, Dragan, PM6 and DFT study of free radical scavenging activity of morin // Food chemistry, 134 (2012), 4; 1754-1760 doi:10.1016/j.foodchem.2012.03.124

Tanabe, Kazutoshi; Lučić, Bono; Amić, Dragan; Kurita, Takio; Kaihara, Mikio; Onodera, Natsuo; Suzuki, Takahiro, Prediction of carcinogenicity for diverse chemicals based on substructure grouping and SVM modeling // Molecular diversity, 14 (2010), 4; 789-802 doi:10.1007/s11030-010-9232-y

Amić, Dragan; Lučić, Bono, Reliability of bond dissociation enthalpy calculated by the PM6 method and experimental TEAC values in antiradical QSAR of flavonoids // Bioorganic & medicinal chemistry, 18 (2010), 1; 28-35 doi:10.1016/j.bmc.2009.11.015

Lučić, Bono; Trinajstić, Nenad; Zhou, Bo, Comparison between the sum-connectivity index and product-connectivity index for benzenoid hydrocarbons // Chemical physics letters, 475 (2009), 1-3; 146-148 doi:10.1016/j.cplett.2009.05.022

Amić, Dragan; Davidović-Amić, Dušanka; Bešlo, Drago; Rastija, Vesna; Lučić, Bono; Trinajstić, Nenad, SAR and QSAR of the Antioxidant Activity of Flavonoids // Current Medicinal Chemistry, 14 (2007), 7; 827-845

Piližota, Teuta; Lučić, Bono; Trinajstić, Nenad, Use of variable selection in modeling the secondary structural content of proteins from their composition of amino acid residues // Journal of Chemical Information and Computer Sciences, 44 (2004), 1; 113-121

Lučić, Bono; Nadramija, Damir; Bašic, Ivan; Trinajstić, Nenad, Toward generating simpler QSAR models: Nonlinear multivariate regression versus several neural network ensembles and some related methods // Journal of chemical information and computer sciences, 43 (2003), 4; 1094-1102

Lučić, Bono; Amić, Dragan; Trinajstić, Nenad, Nonlinear Multivariate Regression Outperforms Several Concisely Designed Neural Networks on Three QSPR Data Sets // Journal of Chemical Information and Computer Sciences, 40 (2000), 2; 403-413

Lučić, Bono; Trinajstić, Nenad; Sild, S.; Karelson, M.; Katritzky, A.R. A new efficient approach for variable selection based on multiregression : prediction of gas chromatographic retention time and response factors // Journal of chemical information and computer sciences, 39 (1999), 3; 610-621

Lučić, Bono; Trinajstić, Nenad, Multivariate regression outperforms several robust architectures of neural networks in QSAR modeling // Journal of chemical information and computer sciences, 39 (1999), 1; 121-132 doi:10.1021/ci980090f

Juretić, Davor; Zucić, Damir; Lučić, Bono; Trinajstić, Nenad, Preference Functions for Prediction of Membrane-buried Helices in Integral Membrane Proteins // Computers & chemistry, 22 (1998), 4; 279-294

Lučić, Bono; Nikolić, Sonja; Trinajstić, Nenad; Juretić, Davor, The Structure-Property Models Can Be Improved Using the Orthogonalized Descriptors // Journal of chemical information and computer sciences, 35 (1995), 532-538 doi:10.1021/ci00025a022

Books and book chapters

Book chapters

• Amić, D., Lučić, B., Amić, A. & Marković, Z. (2016) On the Novel ETE2 and BDE2 Molecular Descriptors of Flavonoid Free Radical Scavenging Potency. U: Putz, M. (ur.) Advances in Chemical Modeling, Volume 6. Hauppauge, N.Y., Nova Science Publishers Inc., str. 245-258.

• Lučić, B., Sović, I. & Trinajstić, N. (2015) The four connectivity matrices, their indices, polynomials and spectra. U: Basak, S., Restrepo, G. & Villaveces, J. (ur.) Advances in mathematical chemistry and applications. Sharjah, UAE, Bentham Science Publishers, str. 76-91.

• Lučić, B., Sović, I. & Trinajstić, N. (2014) On coding and ordering benzenoids and their Kekulé structures by using Kekulé index and some related codes. U: Gutman, I., Pokrić, B. & Vukičević, D. (ur.) Ante Graovac – Life and Works. Kragujevac, University of Kragujevac and Faculty of Science Kragujevac, str. 163-178.

• Juretić, D., Tossi, A., Kamech, N., Ilić, N., Bojović, V., Novković, M., Simunić, J., Petrov, D., Lučić, B., Miljak, M., Ivica, J., Kozić, M. & Vukičević, D. (2013) From Data Collecting to Web servers for Automatic Design of Peptide Antibiotics. U: Paar, V. (ur.) Bioinformatics and biological physics : proceedings of the scientific meeting. Zagreb, Hrvatska akademija znanosti i umjetnosti, str. 63-78. (https://www.bib.irb.hr/680096).

• Verbanac, D., Stepanić, V., Lučić, B. & Amić, D. (2012) “The Must” of the Drug Discovery and Development is – Interdisciplinarity. U: Paar, V. (ur.) Bioinformatics and biological physics : proceedings of the scientific meeting. Zagreb, Croatian Academy of Sciences and Arts, str. 179-189. (https://www.bib.irb.hr/678621).

• Lučić, B., Sović, I., Plavšić, D. & Trinajstić, N. (2012) Harary Matrices: Definitions, Properties and Applications. U: Gutman, I. & Furtula, B. (ur.) Distance in Molecular Graphs – Applications. Kragujevac, University of Kragujevac and Faculty of Science Kragujevac, str. 3-26.

• Lučić, B., Nikolić, S. & Trinajstić, N. (2011) Zagreb Indices. U: Mihai, V., Putz (ur.) Chemical Information and Computational Challenges in the 21st Century - A Celebration of 2011 International Year of Chemistry. New York, Nova Science Publishers, Inc., str. 261-275.

• Lučić, B., Miličević, A., Nikolić, S. & Trinajstić, N. (2011) Coding and Ordering Benzenoids and Their Kekulé Structures. U: Mihai, V., Putz (ur.) Carbon Bonding and Structures - Advances in Physics and Chemistry. Dordrecht, Heidelberg, London, New York, Springer, str. 205-225.

• Lučić, B., Nikolić, S., Trinajstić, N., Zhou, B. & Ivaniš Turk, S. (2010) Sum-connectivity Index. U: Gutman, I. & Furtula, B. (ur.) Novel Molecular Structure Descriptors - Theory and Applications I. Kragujevac, University of Kragujevac, Faculty of Science, str. 101-136.

• Lučić, B., Amić, D. & Trinajstić, N. (2008) Antioxidant QSAR modeling as exemplified on polyphenols. U: Armstrong, D. (ur.) Advanced Protocols in Oxidative Stress I. New York, Humana Press (a part of Springer Science), str. 207-218 doi:10.1007/978-1-60327-517-0_16.

  doi

• Juretić, D., Lučić, B., Zucić, D. & Trinajstić, N. (1998) Prediction by Using Hydrophobicity Scales through Preference Functions. U: Parkanyi, C. (ur.) Theoretical Organic Chemistry. Vol 5: Theoretical and Computational Chemistry. Amsterdam, Elsevier, str. 405-445.

• Lučić, B., Trinajstić, N. & Juretić, D. (1997) Recognition of Membrane Protein Structure from Amino Acid Sequence. U: Balaban, A. (ur.) From Chemical Topology to Three-Dimensional Geometry. New York, Plenum Press, str. 117-158.

Journal articles

Scientific and review papers

• Daghighi, A., Casanola-Martin, G., Timmerman, T., Milenković, D., Lučić, B. & Rasulev, B. (2022) In Silico Prediction of the Toxicity of Nitroaromatic Compounds: Application of Ensemble Learning QSAR Approach. Toxics, 10 (12), 746, 14 doi:10.3390/toxics10120746.

  doiwww.mdpi.com

• Bešlo, D., Došlić, G., Agić, D., Rastija, V., Šperanda, M., Gantner, V. & Lučić, B. (2022) Polyphenols in ruminant nutrition and their effects on reproduction. Antioxidants, 11 (5), 970, 22 doi:10.3390/antiox11050970.

  doi

• Cichońska, A., Ravikumar, B., Allaway, R., Wan, F., Park, S., Isayev, O., Li, S., Mason, M., Lamb, A., Tanoli, Z., Jeon, M., Kim, S., Popova, M., Capuzzi, S., Zeng, J., Dang, K., Koytiger, G., Kang, J., Wells, C., Willson, T., The IDG-DREAM Drug-Kinase Binding Prediction Challenge Consortium, Oršolić, D., Lučić, B., Stepanić, V., Šmuc, T., Oprea, T., Schlessinger, A., Drewry, D., Stolovitzky, G., Wennerberg, K., Guinney, J. & Aittokallio, T. (2021) Crowdsourced mapping of unexplored target space of kinase inhibitors. Nature communications, 12, 3307, 18 doi:10.1038/s41467-021-23165-1.

  doiwww.nature.comdoi.orgfulir.irb.hr

• Lovrić, M., Pavlović, K., Žuvela, P., Spataru, A., Lučić, B., Kern, R. & Wong, M. (2021) Machine learning in prediction of intrinsic aqueous solubility of drug‐like compounds: Generalization, complexity, or predictive ability?. Journal of chemometrics, 35 (7-8), e3349, 16 doi:10.1002/cem.3349.

  doianalyticalsciencejournals.onlinelibrary.wiley.comdoi.orgfulir.irb.hr

• Lovrić, M., Malev, O., Klobučar, G., Kern, R., Liu, J. & Lučić, B. (2021) Predictive Capability of QSAR Models Based on the CompTox Zebrafish Embryo Assays: An Imbalanced Classification Problem. Molecules, 26 (6), 1617, 15 doi:10.3390/molecules26061617.

  doiwww.mdpi.comdoi.orgfulir.irb.hr

• Bešlo, D., Bešlo, K., Agić, D., Vikić- Topić, D. & Lučić, B. (2020) Variations of Total Phenolic Content in Honey Samples Caused by Different Calibration Lines. Croatica chemica acta, 93 (4), 367-375 doi:10.5562/cca3805.

  doihrcak.srce.hr

• Lučić, B., Batista, J., Bojović, V., Lovrić, M., Sović Kržić, A., Bešlo, D., Nadramija, D. & Vikić-Topić, D. (2019) Estimation of random accuracy and its use in validation of predictive quality of classification models within predictive challenges. Croatica chemica acta, 92 (3), 379-391 doi:10.5562/cca3551.

  doihrcak.srce.hrdoi.orgfulir.irb.hr

• Stepanić, V., Matić, S., Amić, A., Lučić, B., Milenković , D. & Marković, Z. (2019) Effects of conjugation metabolism on radical scavenging and transport properties of quercetin – In silico study. Journal of molecular graphics & modelling, 86, 278-285 doi:10.1016/j.jmgm.2018.10.023.

  doi

• Amić, A., Marković, Z., Dimitrić Marković, J., Milenković, D. & Lučić, B. (2019) The role of guaiacyl moiety in free radical scavenging by 3, 5-dihydroxy-4-methoxybenzyl alcohol: Thermodynamics of 3H+/3e- mechanisms. Molecular physics, 117 (2), 207-217 doi:10.1080/00268976.2018.1506174.

  doi

• Matić, S., Jadrijević-Mladar Takač, M., Barbarić, M., Lučić, B., Gall Trošelj, K. & Stepanić, V. (2018) he Influence of In Vivo Metabolic Modifications on ADMET Properties of Green Tea Catechins-In Silico Analysis. Journal of pharmaceutical sciences, 107 (11), 2957-2964 doi:10.1016/j.xphs.2018.07.026.

  doi

• Amić, A., Lučić, B., Stepanić, V., Marković, Z., Marković, S., Dimitrić Marković, J. & Amić, D. (2017) Free radical scavenging potency of quercetin catecholic colonic metabolites: thermodynamics of 2H+/2e- processes. Food chemistry, 218, 144-151 doi:10.1016/j.foodchem.2016.09.018.

  doi

• Amić, A., Lučić, B., Marković, Z. & Amić, D. (2016) Carboxyl Group as a Radical Scavenging Moiety: Thermodynamics of 2H+/2e– Processes of Phloretic Acid. Croatica chemica acta, 89 (4), 517-525 doi:10.5562/cca3024.

  doihrcak.srce.hrdoi.org

• Batista, J., Vikić-Topić, D. & Lučić, B. (2016) The difference between the accuracy of real and the corresponding random model is a useful parameter for validation of two-state classification model quality. Croatica chemica acta, 89 (4), 527-534 doi:10.5562/cca3117.

  doihrcak.srce.hrdoi.orgfulir.irb.hr

• Amić, A., Marković, Z., Dimitrić Marković, J., Jeremić, S., Lučić, B. & Amić, D. (2016) Free radical scavenging and COX-2 inhibition by simple colon metabolites of polyphenols: A theoretical approach. Computational biology and chemistry, 65, 45-53 doi:10.1016/j.compbiolchem.2016.09.013.

  doi

• Amić, A., Marković, Z., Dimitrić Marković, J., Lučić, B., Stepanić, V. & Amić, D. (2016) The 2H+/2e− free radical scavenging mechanisms of uric acid: thermodynamics of N-H bond cleavage. Computational and Theoretical Chemistry, 1077, 2-10 doi:10.1016/j.comptc.2015.09.003.

  doi

• Filipović, M., Marković, Z., Đorović, J., Dimitrić Marković, J., Lučić, B. & Amić, D. (2015) QSAR of the free radical scavenging potency of selected hydroxybenzoic acids and simple phenolics. Comptes rendus. Chimie, 18 (5), 492-498 doi:10.1016/j.crci.2014.09.001.

  doi

• Amić, D., Lučić, B., Amić, A. & Marković, Z. (2014) On the Novel ETE2 and BDE2 Molecular Descriptors of Flavonoid Free Radical Scavenging Potency. International journal of chemical modeling, 6 (2-3), 287-299.

• Dimitrić Marković, J., Amić, D., Lučić, B. & Marković, Z. (2014) Oxidation of kaempferol and its iron(III) complex by DPPH radical: spectroscopic and theoretical study. Monatshefte für Chemie, 145 (4), 557-563 doi:10.1007/s00706-013-1135-z.

  doi

• Lučić, B., Stepanić, V., Plavšić, D., Amić, A. & Amić, D. (2014) Correlation between 13C NMR chemical shifts and antiradical activity of flavonoids. Monatshefte für Chemie, 145 (3), 457-463 doi:10.1007/s00706-013-1130-4.

  doi

• Amić, A., Marković, Z., Dimitrić Marković, J., Stepanić, V., Lučić, B. & Amić, D. (2014) Towards an improved prediction of the free radical scavenging potency of flavonoids: The significance of double PCET mechanisms. Food chemistry, 152, 578-585 doi:10.1016/j.foodchem.2013.12.025.

  doi

• Lučić, B., Sović, I., Bešlo, D., Plavšić, D., Vikić-Topić, D. & Trinajstić, N. (2013) On the Novel Balaban-like and Balaban-Detour-like Molecular Descriptors. International journal of chemical modeling, 5 (2/3), 277-294.

• Stepanić, V., Gall Trošelj, K., Lučić, B., Marković, Z. & Amić, D. (2013) Bond dissociation free energy as a general parameter for flavonoid radical scavenging activity. Food chemistry, 141 (2), 1562-1570 doi:10.1016/j.foodchem.2013.03.072.

  doi

• Amić, D., Stepanić, V., Lučić, B., Marković, Z. & Dimitrić Marković, J. (2013) PM6 study of free radical scavenging mechanisms of flavonoids: why does O–H bond dissociation enthalpy effectively represent free radical scavenging activity?. Journal of molecular modeling, 19 (6), 2593-2603 doi:10.1007/s00894-013-1800-5.

  doi

• Marković, Z., Milenković, D., Đorović, J., Dimitrić Marković, J., Lučić, B. & Amić, D. (2013) A DFT and PM6 study of free radical scavenging activity of ellagic acid. Monatshefte für Chemie, 144 (6), 803-812 doi:10.1007/s00706-013-0949-z.

  doi

• Tanabe, K., Kurita, T., Nishida, K., Lučić, B., Amić, D. & Suzuki, T. (2013) Improvement of carcinogenicity prediction performances based on sensitivity analysis in variable selection of SVM models. SAR and QSAR in environmental research, 24 (7), 565-580.

• Dimitrić Marković, J., Marković, Z., Krstić, J., Milenković, D., Lučić, B. & Amić, D. (2013) Interpretation of the IR and Raman spectra of morin by density functional theory and comparative analysis. Vibrational spectroscopy, 64, 1-9 doi:10.1016/j.vibspec.2012.10.006.

  doi

• Lučić, B., Sović, I., Batista, J., Skala, K., Plavšić, D., Vikić-Topić, D., Bešlo, D., Nikolić, S. & Trinajstić, N. (2013) The Sum-Connectivity Index - An Additive Variant of the Randić Connectivity Index. Current computer-aided drug design, 9 (2), 184-194 doi:10.2174/1573409911309020004.

  doi

• Marković, Z., Milenković, D., Đorović, J., Dimitrić Marković, J., Stepanić, V., Lučić, B. & Amić, D. (2012) Free radical scavenging activity of morin 2’-O− phenoxide anion. Food chemistry, 135 (3), 2070-2077 doi:10.1016/j.foodchem.2012.05.119.

  doi

• Marković, Z., Milenković, D., Đorović, J., Dimitrić Marković, J., Stepanić, V., Lučić, B. & Amić, D. (2012) PM6 and DFT study of free radical scavenging activity of morin. Food chemistry, 134 (4), 1754-1760 doi:10.1016/j.foodchem.2012.03.124.

  doi

• Juretić, D., Vukičević, D., Petrov, D., Novković, M., Bojović, V., Lučić, B., Ilić, N. & Tossi, A. (2011) Knowledge-based computational methods for identifying or designing novel, non-homologous antimicrobial peptides. European biophysics journal, 40 (4), 371-385 doi:10.1007/s00249-011-0674-7.

  doi

• Vukičević, D., Trinajstić, N., Nikolić, S., Lučić, B. & Zhou, B. (2010) Master connectivity index and master connectivity polynomial. Current computer-aided drug design, 6 (4), 235-239 doi:10.2174/1573409911006040235.

  doi

• Tanabe, K., Lučić, B., Amić, D., Kurita, T., Kaihara, M., Onodera, N. & Suzuki, T. (2010) Prediction of carcinogenicity for diverse chemicals based on substructure grouping and SVM modeling. Molecular diversity, 14 (4), 789-802 doi:10.1007/s11030-010-9232-y.

  doi

• Amić, D. & Lučić, B. (2010) Reliability of bond dissociation enthalpy calculated by the PM6 method and experimental TEAC values in antiradical QSAR of flavonoids. Bioorganic & medicinal chemistry, 18 (1), 28-35 doi:10.1016/j.bmc.2009.11.015.

  doi

• Lučić, B., Trinajstić, N. & Zhou, B. (2009) Comparison between the sum-connectivity index and product-connectivity index for benzenoid hydrocarbons. Chemical physics letters, 475 (1-3), 146-148 doi:10.1016/j.cplett.2009.05.022.

  doi

• Amić, D., Lučić, B., Kovačević, G. & Trinajstić, N. (2009) Bond dissociation enthalpies calculated by the PM3 method confirm activity cliffs in radical scavenging of flavonoids. Molecular diversity, 13 (1), 27-36 doi:10.1007/s11030-008-9095-7.

  doi

• Lučić, B., Nikolić, S. & Trinajstić, N. (2008) Distance-Related Molecular Descriptors. Magyar kémiai folyóirat, Kémiai közlemények, 114 (4), 171-175.

• Lučić, B., Nikolić, S. & Trinajstić, N. (2008) Distance-Related Molecular Descriptors. Internet electronic journal of molecular design, 7, 195-206.

• Janežič, D., Lučić, B., Miličević, A., Nikolić, S., Trinajstić, N. & Vukičević, D. (2007) Hosoya Matrices as the Numerical Realization of Graphical Matrices and Derived Structural Descriptors. Croatica Chemica Acta, 80 (2), 271-276.

• Amić, D., Davidović-Amić, D., Bešlo, D., Rastija, V., Lučić, B. & Trinajstić, N. (2007) SAR and QSAR of the Antioxidant Activity of Flavonoids. Current Medicinal Chemistry, 14 (7), 827-845.

• Janežič, D., Lučić, B., Nikolić, S., Miličević, A. & Trinajstić, N. (2006) Boiling Points of Alcohols - A Comparative QSPR Study. Internet Electronic Journal of Molecular Design, 5 (4), 192-200.

• Supek, F., Šmuc, T. & Lučić, B. (2005) A prototype structure-activity relationship model based on National Cancer Institute cell line screening data. Periodicum Biologorum, 107 (4), 451-455.

• Piližota, T., Lučić, B. & Trinajstić, N. (2004) Use of variable selection in modeling the secondary structural content of proteins from their composition of amino acid residues. Journal of Chemical Information and Computer Sciences, 44 (1), 113-121.

• Lučić, B., Nadramija, D., Bašic, I. & Trinajstić, N. (2003) Toward generating simpler QSAR models: Nonlinear multivariate regression versus several neural network ensembles and some related methods. Journal of chemical information and computer sciences, 43 (4), 1094-1102.

• Lučić, B., Miličević, A., Nikolić, S. & Trinajstić, N. (2003) On variable Wiener index. Indian journal of chemistry. Sect. A: Inorganic, physical, theoretical & analytical, 42 (6), 1279-1282.

• Amić, D., Basak S.C., Lučić, B., Nikolić, S. & Trinajstić, N. (2002) Structure-water solubility modeling of aliphatic alcohols using the weighted path numbers. SAR and QSAR in environmental research, 13 (2), 281-295 doi:10.1080/10629360290002776.

  doi

• Lučić, B., Bašic, I., Nadramija, D., Miličević, A., Trinajstić, N., Suzuki, T., Petrukhin, R., Karelson, M. & Katritzky, Alan, R. (2002) Correlation of liquid viscosity with molecular structure for organic compounds using different variable selection methods. ARKIVOC, (4), 45-59 doi:10.3998/ark.5550190.0003.406.

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• Lučić, B., Miličević, A., Nikolić, S. & Trinajstić, N. (2002) Harary index - Twelve years later. Croatica chemica acta, 75 (4), 847-868. (https://www.bib.irb.hr/81657).

• Amić, D., Lučić, B., Nikolić, S. & Trinajstić, N. (2001) Predicting inhibition of microsomal p-hydroxylation of aniline by aliphatic alcohols: a QSAR approach based on the weighted path numbers. Croatica chemica acta, 74 (2), 237-250.

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• Lučić, B., Istvan, L., Nikolić, S. & Nenad, T. (2001) Distance-related indexes in the quantitative structure-property relationship modeling. Journal of chemical information and computer sciences, 41, 527-535.

• Lučić, B., Amić, D. & Trinajstić, N. (2000) Nonlinear Multivariate Regression Outperforms Several Concisely Designed Neural Networks on Three QSPR Data Sets. Journal of Chemical Information and Computer Sciences, 40 (2), 403-413.

• Katritzky, A., Chen, K., Wang, Y., Karelson, M., Lučić, B., Trinajstić, N., Suzuki, T. & Schüürmann, G. (2000) Prediction of liquid viscosity for organic compounds by a quantative structure-property relationship. Journal of physical organic chemistry, 13 (1), 80-86.

• Basak, S., Gute, B., Lučić, B., Nikolić, S. & Trinajstić, N. (2000) A comparative QSAR study of benzamidines complement-inhibitory activity and benzene derivatives acute toxicity. Computers and chemistry, 24 (2), 181-191.

• Amić, D., Davidović-Amić, D., Bešlo, D., Lučić, B. & Trinajstić, N. (1999) Prediction of pK Values, half-lives and electronic spectra of flavylium salts from molecular structure. Journal of chemical information and computer sciences, 39 (6), 967-973.

• Lučić, B., Trinajstić, N., Sild, S., Karelson, M. & Katritzky, A. (1999) A new efficient approach for variable selection based on multiregression : prediction of gas chromatographic retention time and response factors. Journal of chemical information and computer sciences, 39 (3), 610-621.

• Lučić, B. & Trinajstić, N. (1999) Multivariate regression outperforms several robust architectures of neural networks in QSAR modeling. Journal of chemical information and computer sciences, 39 (1), 121-132 doi:10.1021/ci980090f.

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• Juretić, D., Zucić, D., Lučić, B. & Trinajstić, N. (1998) Preference Functions for Prediction of Membrane-buried Helices in Integral Membrane Proteins. Computers & chemistry, 22 (4), 279-294.

• Amić, D., Bešlo, D., Lučić, B., Nikolić, S. & Trinajstić, N. (1998) The vertex-connectivity index revisited. Journal of chemical information and computer sciences, 38 (5), 819-822.

• Amić, D., Davidović-Amić, D., Bešlo, D., Lučić, B. & Trinajstić, N. (1998) QSAR of flavylium salts as inhibitors of xanthine oxidase. Journal of chemical information and computer sciences, 38 (5), 815-818.

• Amić, D., Davidović-Amić, D., Bešlo, D., Lučić, B. & Trinajstić, N. (1997) A simple QSAR model for trypsin aminopeptidase inhibitory flavonoids. Croatica chemica acta, 70 (4), 905-911.

• Trinajstić, N., Nikolić, S., Lučić, B., Amić, D. & Mihalić, Z. (1997) The detour matrix in chemistry. Journal of chemical information and computer sciences, 37 (4), 631-638 doi:10.1021/ci960149n.

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• Amić, D., Davidović-Amić, D., Bešlo, D., Trinajstić, N. & Lučić, B. (1997) The use of the ordered orthogonalized multivariate linear regression in a structure-activity study of coumarin and flavonoid derivatives as inhibitors of aldose reductase. Journal of chemical information and computer sciences, 37 (3), 581-586 doi:10.1021/ci960158w.

  doi

• Lučić, B. & Trinajstić, N. (1997) New Development in QSPR/QSAR Modeling Based on Topological Indices. SAR and QSAR in environmental research, 5, 45-62.

• Klein, D., Randić, M., Babić, D., Lučić, B., Nikolić, S. & Trinajstić, N. (1997) Hierarchical Orthogonalization of Descriptors. International journal of quantum chemistry, 63 (1), 215-222 doi:10.1002/(SICI)1097-461X(1997)63:13.0.CO ; 2-.

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• Trinajstić, N., Nikolić, S., Lučić, B. & Amić, D. (1996) On QSAR Modeling. Acta pharmaceutica, 46 (4), 249-263.

• Amić, D., Davidović-Amić, D., Bešlo, D., Lučić, B. & Trinajstić, N. (1995) Structure-activity correlation of flavone derivatives for inhibition of cAMP phosphodiesterase. Journal of chemical information and computer sciences, 35 (6), 1034-1038 doi:10.1021/ci00028a013.

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• Juretić, D., Lučić, B. & Trinajstić, N. (1995) Secondary Structure Prediction Quality for Naturally Occurring Amino Acids in Soluble Proteins. Journal of molecular structure. Theochem, 338, 43-50 doi:10.1016/0166-1280(94)04047-V.

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• Lučić, B., Nikolić, S., Trinajstić, N. & Juretić, D. (1995) The Structure-Property Models Can Be Improved Using the Orthogonalized Descriptors. Journal of chemical information and computer sciences, 35, 532-538 doi:10.1021/ci00025a022.

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• Lučić, B., Nikolić, S., Trinajstić, N., Juretić, D. & Jurić, A. (1995) Novel QSPR Approach to Physicochemical Properties of the Alpha-Amino-Acids. Croatica Chemica Acta, 68 (3), 435-450.

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• Lučić, B., Nikolić, S., Trinajstić, N., Jurić, A. & Mihalić, Z. (1995) A Structure-Property Study of the Solubility of Aliphatic-Alcohols in Water. Croatica chemica acta, 68 (3), 417-434.

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• Juretić, D., Trinajstić, N. & Lučić, B. (1993) Protein Secondary Structure Conformations and Associated Hydrophobicity Scale. Journal of mathematical chemistry, 14 (1), 35-45 doi:10.1007/BF01164453.

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• Juretić, D., Lučić, B. & Trinajstić, N. (1993) Predicting Membrane Protein Secondary Structure: Preference Functions Method for Finding Optimal Conformational Parameters. Croatica Chemica Acta, 66 (2), 201-208.

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Member of IUPAC Committee on Publications and Cheminformatics Data Standards (2012-2019), former name Committee for Printed and Electronic Publications (2012- 2014)

Croatian Chemical Society

Croatian Biophysical Society

Croatian Society for Theoretical and Mathematical Biology

Croatian Cultural Society "Napredak", Sarajevo