-
Tartaro Bujak, Ivana; Klarić, David; Lučić, Bono; Bojanić, Krunoslav; Bujak, Maro; Galić, Nives | Radiolytic Elimination of Nabumetone from Aqueous Solution: Degradation Efficiency, and Degradants’ Toxicity // Molecules, 30 (2025), 1; 64, 21. doi: 10.3390/molecules30010064
doiwww.mdpi.com
-
Vujica, Lana; Lončar, Jovica; Mišić, Lana; Lučić, Bono; Radman, Katarina; Mihaljević, Ivan; Bertoša, Branimir; Mesarić, Josip; Horvat, Marina; Smital, Tvrtko | Environmental contaminants modulate transport activity of zebrafish (Danio rerio) multidrug and toxin extrusion protein 3 (Mate3/Slc47a2.1) // Science of the total environment, 901 (2023), doi: 10.1016/j.scitotenv.2023.165956
doiwww.sciencedirect.com
-
Daghighi, Amirreza ; Casanola-Martin, Gerardo M. ; Timmerman, Troy ; Milenković, Dejan ; Lučić, Bono ; Rasulev, Bakhtiyor | In Silico Prediction of the Toxicity of Nitroaromatic Compounds: Application of Ensemble Learning QSAR Approach // Toxics, 10 (2022), 12; 746, 14. doi: 10.3390/toxics10120746
doiwww.mdpi.comfulir.irb.hr
-
Bešlo, Drago ; Došlić, Gloria ; Agić, Dejan ; Rastija, Vesna ; Šperanda, Marcela ; Gantner, Vesna ; Lučić, Bono | Polyphenols in ruminant nutrition and their effects on reproduction // Antioxidants, 11 (2022), 5; 970, 22. doi: 10.3390/antiox11050970
doifulir.irb.hrwww.mdpi.com
-
Bešlo, Drago; Bešlo, Klara; Agić, Dejan; Vikić-Topić, Dražen; Lučić, Bono | Variations of Total Phenolic Content in Honey Samples Caused by Different Calibration Lines // Croatica chemica acta, 93 (2020), 4; 367-375. doi: 10.5562/cca3805
doihrcak.srce.hrfulir.irb.hr
-
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
doiwww.nature.comdoi.orgfulir.irb.hr
-
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
doianalyticalsciencejournals.onlinelibrary.wiley.comdoi.orgfulir.irb.hr
-
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
doiwww.mdpi.comdoi.orgfulir.irb.hr
-
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; 379-391. doi: 10.5562/cca3551
doihrcak.srce.hrdoi.orgfulir.irb.hr
-
Stepanić, Višnja ; Matić, Sara ; Amić, Ana ; Lučić, Bono ; Milenković , Dejan ; Marković, Zoran | Effects of conjugation metabolism on radical scavenging and transport properties of quercetin – In silico study // Journal of molecular graphics & modelling, 86 (2019), 278-285. doi: 10.1016/j.jmgm.2018.10.023
doiwww.sciencedirect.com
-
Matić, Sara ; Jadrijević-Mladar Takač, Milena ; Barbarić, Monika ; Lučić, Bono ; Gall Trošelj, Koraljka ; Stepanić, Višnja | he Influence of In Vivo Metabolic Modifications on ADMET Properties of Green Tea Catechins-In Silico Analysis // Journal of pharmaceutical sciences, 107 (2018), 11; 2957-2964. doi: 10.1016/j.xphs.2018.07.026
doiwww.sciencedirect.com
-
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: 10.1080/00268976.2018.1506174
doiwww.tandfonline.comdoi.org
-
Amić, Ana ; Lučić, Bono ; Marković, Zoran ; Amić, Dragan | Carboxyl Group as a Radical Scavenging Moiety: Thermodynamics of 2H+/2e– Processes of Phloretic Acid // Croatica chemica acta, 89 (2016), 4; 517-525. doi: 10.5562/cca3024
doihrcak.srce.hrdoi.org
-
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
doihrcak.srce.hrdoi.orgfulir.irb.hr
-
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
doiwww.sciencedirect.com
-
Amić, Ana ; Marković, Zoran ; Dimitrić Marković, Jasmina ; Jeremić, Svetlana ; Lučić, Bono ; Amić, Dragan | Free radical scavenging and COX-2 inhibition by simple colon metabolites of polyphenols: A theoretical approach // Computational biology and chemistry, 65 (2016), 45-53. doi: 10.1016/j.compbiolchem.2016.09.013
doiwww.sciencedirect.com
-
Amić, Ana ; Marković, Zoran ; Dimitrić Marković, Jasmina ; Lučić, Bono ; Stepanić, Višnja ; Amić, Dragan | The 2H+/2e− free radical scavenging mechanisms of uric acid: thermodynamics of N-H bond cleavage // Computational and theoretical chemistry, 1077 (2016), 2-10. doi: 10.1016/j.comptc.2015.09.003
doiwww.sciencedirect.comdx.doi.org
-
Amić, Dragan ; Davidović-Amić, Dušanka ; Bešlo, Drago ; Lučić, Bono ; Trinajstić, Nenad | Structure-activity correlation of flavone derivatives for inhibition of cAMP phosphodiesterase // Journal of chemical information and computer sciences, 35 (1995), 6; 1034-1038. doi: 10.1021/ci00028a013
doipubs.acs.orgdoi.org
-
Juretić, Davor ; Lučić, Bono ; Trinajstić, Nenad | Secondary Structure Prediction Quality for Naturally Occurring Amino Acids in Soluble Proteins // Journal of molecular structure. Theochem, 338 (1995), 43-50. doi: 10.1016/0166-1280(94)04047-V
doiwww.sciencedirect.com
-
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
doipubs.acs.org
-
Juretić, Davor ; Trinajstić, Nenad ; Lučić, Bono | Protein Secondary Structure Conformations and Associated Hydrophobicity Scale // Journal of mathematical chemistry, 14 (1993), 1; 35-45. doi: 10.1007/BF01164453
doilink.springer.com
-
Juretić, Davor ; Lučić, Bono ; Trinajstić, Nenad | Predicting Membrane Protein Secondary Structure: Preference Functions Method for Finding Optimal Conformational Parameters // Croatica chemica acta, 66 (1993), 2; 201-208
hrcak.srce.hrhrcak.srce.hr
-
Lučić, Bono ; Nikolić, Sonja ; Trinajstić, Nenad ; Juretić, Davor ; Jurić, Albin | Novel QSPR Approach to Physicochemical Properties of the Alpha-Amino-Acids // Croatica chemica acta, 68 (1995), 3; 435-450
hrcak.srce.hrhrcak.srce.hr
-
Lučić, Bono ; Nikolić, Sonja ; Trinajstić, Nenad ; Jurić, Albin ; Mihalić, Zlatko | A Structure-Property Study of the Solubility of Aliphatic-Alcohols in Water // Croatica chemica acta, 68 (1995), 3; 417-434
hrcak.srce.hr
Amić, Dragan ; Lučić, Bono ; Amić, Ana ; Marković, Zoran | On the Novel ETE2 and BDE2 Molecular Descriptors of Flavonoid Free Radical Scavenging Potency // International journal of chemical modeling, 6 (2014), 2-3; 287-299
-
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
doiwww.sciencedirect.com
-
Dimitrić Marković, Jasmina ; Amić, Dragan ; Lučić, Bono ; Marković, Zoran | Oxidation of kaempferol and its iron(III) complex by DPPH radical: spectroscopic and theoretical study // Monatshefte für Chemie, 145 (2014), 4; 557-563. doi: 10.1007/s00706-013-1135-z
doilink.springer.comdoi.org
-
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
doilink.springer.comdoi.org
-
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
doidoi.orgwww.sciencedirect.com
-
Lučić, Bono ; Sović, Ivan ; Bešlo, Drago ; Plavšić, Dejan ; Vikić-Topić, Dražen ; Trinajstić, Nenad. | On the Novel Balaban-like and Balaban-Detour-like Molecular Descriptors // International journal of chemical modeling, 5 (2013), 2/3; 277-294
www.novapublishers.com
-
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
doiwww.sciencedirect.comac.els-cdn.comdx.doi.org
-
Amić, Dragan ; Stepanić, Višnja ; Lučić, Bono ; Marković, Zoran ; Dimitrić Marković, Jasmina | 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 (2013), 6; 2593-2603. doi: 10.1007/s00894-013-1800-5
doilink.springer.comdoi.org
-
Marković, Zoran ; Milenković, Dejan ; Đorović, Jelena ; Dimitrić Marković, Jasmina ; Lučić, Bono ; Amić, Dragan | A DFT and PM6 study of free radical scavenging activity of ellagic acid // Monatshefte für Chemie, 144 (2013), 6; 803-812. doi: 10.1007/s00706-013-0949-z
doilink.springer.comdoi.org
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
-
Dimitrić Marković, Jasmina ; Marković, Zoran ; Krstić, Jugoslav ; Milenković, Dejan ; Lučić, Bono ; Amić, Dragan | Interpretation of the IR and Raman spectra of morin by density functional theory and comparative analysis // Vibrational spectroscopy, 64 (2013), 1-9. doi: 10.1016/j.vibspec.2012.10.006
doiwww.sciencedirect.comdoi.org
-
Marković, Zoran ; Milenković, Dejan ; Đorović, Jelena ; Dimitrić Marković, Jasmina ; Stepanić, Višnja ; Lučić, Bono ; Amić, Dragan | Free radical scavenging activity of morin 2’-O− phenoxide anion // Food chemistry, 135 (2012), 3; 2070-2077. doi: 10.1016/j.foodchem.2012.05.119
doidx.doi.orgwww.sciencedirect.com
-
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
doieurekaselect.com
-
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
doidx.doi.orgwww.sciencedirect.com
-
Vukičević, Damir ; Trinajstić, Nenad ; Nikolić, Sonja ; Lučić, Bono ; Zhou, Bo | Master connectivity index and master connectivity polynomial // Current computer-aided drug design, 6 (2010), 4; 235-239. doi: 10.2174/1573409911006040235
doiwww.eurekaselect.com
-
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
doilink.springer.comdoi.org
-
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
doiwww.sciencedirect.comdoi.org
-
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
doiwww.sciencedirect.comdoi.org
-
Amić, Dragan ; Lučić, Bono ; Kovačević, Goran ; Trinajstić, Nenad | Bond dissociation enthalpies calculated by the PM3 method confirm activity cliffs in radical scavenging of flavonoids // Molecular diversity, 13 (2009), 1; 27-36. doi: 10.1007/s11030-008-9095-7
doilink.springer.comdoi.org
-
Lučić, Bono ; Nikolić, Sonja ; Trinajstić, Nenad | Distance-Related Molecular Descriptors // Internet electronic journal of molecular design, 7 (2008), 195-206
biochempress.com
Janežič, Dušanka ; Lučić, Bono ; Miličević, Ante ; Nikolić, Sonja ; Trinajstić, Nenad ; Vukičević, Damir | Hosoya Matrices as the Numerical Realization of Graphical Matrices and Derived Structural Descriptors // Croatica chemica acta, 80 (2007), 2; 271-276
-
Janežič, Dušanka ; Lučić, Bono ; Nikolić, Sonja ; Miličević, Ante ; Trinajstić, Nenad | Boiling Points of Alcohols - A Comparative QSPR Study // Internet electronic journal of molecular design, 5 (2006), 4; 192-200-x
biochempress.com
Supek, Fran ; Šmuc, Tomislav ; Lučić, Bono | A prototype structure-activity relationship model based on National Cancer Institute cell line screening data // Periodicum biologorum, 107 (2005), 4; 451-455-x
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-x
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-x
Lučić, Bono ; Miličević, Ante ; Nikolić, Sonja ; Trinajstić, Nenad | On variable Wiener index // Indian journal of chemistry. Sect. A: Inorganic, physical, theoretical & analytical, 42 (2003), 6; 1279-1282-x
-
Amić, Dragan ; Basak S.C. ; Lučić, Bono ; Nikolić, Sonja ; Trinajstić, Nenad | Structure-water solubility modeling of aliphatic alcohols using the weighted path numbers // SAR and QSAR in environmental research, 13 (2002), 2; 281-295. doi: 10.1080/10629360290002776
doiwww.tandfonline.com
-
Lučić, Bono ; Bašic, Ivan ; Nadramija, Damir ; Miličević, Ante ; Trinajstić, Nenad ; Suzuki, Takahiro ; Petrukhin, Ruslan ; Karelson, Mati ; Katritzky, Alan, R. | Correlation of liquid viscosity with molecular structure for organic compounds using different variable selection methods // ARKIVOC, (2002), 4; 45-59. doi: 10.3998/ark.5550190.0003.406
doiquod.lib.umich.edu
Lučić, Bono ; Miličević, Ante ; Nikolić, Sonja ; Trinajstić, Nenad | Harary index - Twelve years later // Croatica chemica acta, 75 (2002), 4; 847-868
-
Amić, Dragan ; Lučić, Bono ; Nikolić, Sonja ; Trinajstić, Nenad | Predicting inhibition of microsomal p- hydroxylation of aniline by aliphatic alcohols: a QSAR approach based on the weighted path numbers // Croatica chemica acta, 74 (2001), 2; 237-250
hrcak.srce.hr
Lučić, Bono ; Istvan, Lukovits ; Nikolić, Sonja ; Nenad, Trinajstić | Distance-related indexes in the quantitative structure-property relationship modeling // Journal of chemical information and computer sciences, 41 (2001), 527-535
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-x
Katritzky, A.R. ; Chen, K. ; Wang, Y. ; Karelson, M. ; Lučić, Bono ; Trinajstić, Nenad ; Suzuki, T. ; Schüürmann, G. | Prediction of liquid viscosity for organic compounds by a quantative structure-property relationship // Journal of physical organic chemistry, 13 (2000), 1; 80-86-x
Basak, S.C. ; Gute, B.D. ; Lučić, Bono ; Nikolić, Sonja ; Trinajstić, Nenad | A comparative QSAR study of benzamidines complement-inhibitory activity and benzene derivatives acute toxicity // Computers & chemistry, 24 (2000), 2; 181-191-x
Amić, Dragan ; Davidović-Amić, Dušanka ; Bešlo, Drago ; Lučić, Bono ; Trinajstić, Nenad | Prediction of pK Values, half-lives and electronic spectra of flavylium salts from molecular structure // Journal of chemical information and computer sciences, 39 (1999), 6; 967-973-x
Trinajstić, Nenad ; Nikolić, Sonja ; Lučić, Bono ; Amić, Dragan | On QSAR Modeling // Acta pharmaceutica, 46 (1996), 4; 249-263
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-x
-
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
doipubs.acs.orgpubs.acs.org
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-x
Amić, Dragan ; Bešlo, Drago ; Lučić, Bono ; Nikolić, Sonja ; Trinajstić, Nenad | The vertex-connectivity index revisited // Journal of chemical information and computer sciences, 38 (1998), 5; 819-822-x
Amić, Dragan ; Davidović-Amić, Dušanka ; Bešlo, Drago ; Lučić, Bono ; Trinajstić, Nenad | A simple QSAR model for trypsin aminopeptidase inhibitory flavonoids // Croatica chemica acta, 70 (1997), 4; 905-911-x
-
Trinajstić, Nenad ; Nikolić, Sonja ; Lučić, Bono ; Amić, Dragan ; Mihalić, Zlatko | The detour matrix in chemistry // Journal of chemical information and computer sciences, 37 (1997), 4; 631-638. doi: 10.1021/ci960149n
doipubs.acs.orgdoi.org
-
Amić, Dragan ; Davidović-Amić, Dušanka ; Bešlo, Drago ; Trinajstić, Nenad ; Lučić, Bono | 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 (1997), 3; 581-586. doi: 10.1021/ci960158w
doipubs.acs.orgdoi.org
Amić, Dragan ; Davidović-Amić, Dušanka ; Bešlo, Drago ; Lučić, Bono ; Trinajstić, Nenad | QSAR of flavylium salts as inhibitors of xanthine oxidase // Journal of chemical information and computer sciences, 38 (1998), 5; 815-818-x
Lučić, Bono ; Trinajstić, Nenad | New Development in QSPR/QSAR Modeling Based on Topological Indices // SAR and QSAR in environmental research, 5 (1997), 45-62
-
Klein, D.J. ; Randić, Milan ; Babić, Darko ; Lučić, Bono ; Nikolić, Sonja ; Trinajstić, Nenad | Hierarchical Orthogonalization of Descriptors // International journal of quantum chemistry, 63 (1997), 1; 215-222. doi: 10.1002/(SICI)1097-461X(1997)63:1<215::AID-QUA22>3.0.CO;2-9
doionlinelibrary.wiley.comonlinelibrary.wiley.com
