Search Results - "Veselinovic, Jovana B"

The study of the index of ideality of correlation as a new criterion of predictive potential of QSPR/QSAR-models by Toropov, Andrey A., Raška, Ivan, Toropova, Alla P., Raškova, Maria, Veselinović, Aleksandar M., Veselinović, Jovana B.

“…Acetylcholinesterase (AChE) inhibitors, dihydrofolate reductase inhibitors (DHFR), Toxicity in Tetrahymena pyriformis (TP), Acute Toxicity in fathead minnow…”
Get full text

Semi-correlations combined with the index of ideality of correlation: a tool to build up model of mutagenic potential by Toropova, Alla P., Toropov, Andrey A., Veselinović, Aleksandar M., Veselinović, Jovana B., Leszczynska, Danuta, Leszczynski, Jerzy

“…Mutagenicity is the ability of a substance to induce mutations. This hazardous ability of a substance is decisive from point of view of ecotoxicology. The…”
Get full text

Application of SMILES Notation Based Optimal Descriptors in Drug Discovery and Design by Veselinović, Aleksandar M, Veselinović, Jovana B, Živković, Jelena V, Nikolić, Goran M

“…SMILES notation based optimal descriptors as a universal tool for the QSAR analysis with further application in drug discovery and design is presented. The…”
Get more information

Monte Carlo-based quantitative structure-activity relationship models for toxicity of organic chemicals to Daphnia magna by Toropova, Alla P., Toropov, Andrey A., Veselinović, Aleksandar M., Veselinović, Jovana B., Leszczynska, Danuta, Leszczynski, Jerzy

“…Quantitative structure–activity relationships (QSARs) for toxicity of a large set of 758 organic compounds to Daphnia magna were built up. The simplified…”
Get full text

QSAR as a random event: a case of NOAEL by Toropova, Alla P, Toropov, Andrey A, Veselinović, Jovana B, Veselinović, Aleksandar M

“…Quantitative structure–activity relationships (QSAR) for no observed adverse effect levels (NOAEL, mmol/kg/day, in logarithmic units) are suggested. Simplified…”
Get full text

Nano-QSAR: Model of mutagenicity of fullerene as a mathematical function of different conditions by Toropova, Alla P., Toropov, Andrey A., Veselinović, Aleksandar M., Veselinović, Jovana B., Benfenati, Emilio, Leszczynska, Danuta, Leszczynski, Jerzy

“…The experimental data on the bacterial reverse mutation test (under various conditions) on C60 nanoparticles for the cases (i) TA100, and (ii) WP2uvrA/pkM101…”
Get full text

QSAR models for HEPT derivates as NNRTI inhibitors based on Monte Carlo method by Toropova, Alla P., Toropov, Andrey A., Veselinović, Jovana B., Miljković, Filip N., Veselinović, Aleksandar M.

“…A series of 107 1-[(2-hydroxyethoxy)-methyl]-6-(phenylthio) thymine (HEPT) with anti-HIV-1 activity as a non-nucleoside reverse transcriptase inhibitor (NNRTI)…”
Get full text

The Monte Carlo technique as a tool to predict LOAEL by Veselinović, Jovana B., Veselinović, Aleksandar M., Toropova, Alla P., Toropov, Andrey A.

“…Quantitative structure – activity relationships (QSARs) for the Lowest Observed Adverse Effect Level (LOAEL) for a large set of organic compounds (n = 341) are…”
Get full text

Potent anti-melanogenic activity and favorable toxicity profile of selected 4-phenyl hydroxycoumarins in the zebrafish model and the computational molecular modeling studies by Veselinović, Jovana B., Veselinović, Aleksandar M., Ilic-Tomic, Tatjana, Davis, Reeta, O'Connor, Kevin, Pavic, Aleksandar, Nikodinovic-Runic, Jasmina

“…[Display omitted] •4-Phenyl hydroxycoumarins (7C and 5,7C) have anti-melanogenic activity.•7C and 5,7C showed depigmenting and anti-tyrosinase activity in vivo…”
Get full text

QSPR in forensic analysis – The prediction of retention time of pesticide residues based on the Monte Carlo method by Zdravković, Miodrag, Antović, Aleksandra, Veselinović, Jovana B., Sokolović, Dušan, Veselinović, Aleksandar M.

“…A method for the prediction of retention indices of pesticides using the Monte Carlo method and with optimal molecular descriptors based on local graph…”
Get full text

In silico prediction of the β-cyclodextrin complexation based on Monte Carlo method by Veselinović, Aleksandar M., Veselinović, Jovana B., Toropov, Andrey A., Toropova, Alla P., Nikolić, Goran M.

“…[Display omitted] In this study QSPR models were developed to predict the complexation of structurally diverse compounds with β-cyclodextrin based on SMILES…”
Get full text

QSAR modeling of the antimicrobial activity of peptides as a mathematical function of a sequence of amino acids by Toropova, Mariya A., Veselinović, Aleksandar M., Veselinović, Jovana B., Stojanović, Dušica B., Toropov, Andrey A.

“…[Display omitted] •QSAR models for mastoparan analogs as antibacterial agents are developed.•Mathematical function of a sequence of amino acids was used for…”
Get full text

QSAR modeling of dihydrofolate reductase inhibitors as a therapeutic target for multiresistant bacteria by Veselinović, Jovana B., Đorđević, Vukica, Bogdanović, Milena, Morić, Ivana, Veselinović, Aleksandar M.

“…Antibacterial resistance is a growing public health threat of major concern around the world so development of new therapeutic approaches to prevent bacterial…”
Get full text

Antioxidant properties of selected 4-phenyl hydroxycoumarins: Integrated in vitro and computational studies by Veselinović, Jovana B., Veselinović, Aleksandar M., Vitnik, Željko J., Vitnik, Vesna D., Nikolić, Goran M.

“…•For selected hydroxy 4-phenyl coumarins antioxidant properties are determined.•7,8-Dihydroxy-4-phenyl coumarin is a promising antioxidant compound.•SAR for…”
Get full text

Biological activity of Pinus nigra terpenes—Evaluation of FtsZ inhibition by selected compounds as contribution to their antimicrobial activity by Šarac, Zorica, Matejić, Jelena S, Stojanović-Radić, Zorica Z, Veselinović, Jovana B, Džamić, Ana M, Bojović, Srdjan, Marin, Petar D

“…Abstract In the current work, in vitro antioxidant, antibacterial, and antifungal activites of the needle terpenes of three taxa of Pinus nigra from Serbia…”
Get full text

Monte Carlo method based QSAR modeling of maleimide derivatives as glycogen synthase kinase-3β inhibitors by ivkovic, Jelena V, Trutic, Natasa V, Veselinovic, Jovana B, Nikolic, Goran M, Veselinovic, Aleksandar M

“…Abstract The Monte Carlo method was used for QSAR modeling of maleimide derivatives as glycogen synthase kinase-3β inhibitors. The first QSAR model was…”
Get full text

Selected 4-phenyl hydroxycoumarins: In vitro cytotoxicity, teratogenic effect on zebrafish (Danio rerio) embryos and molecular docking study by Veselinović, Jovana B., Kocić, Gordana M., Pavic, Aleksandar, Nikodinovic-Runic, Jasmina, Senerovic, Lidija, Nikolić, Goran M., Veselinović, Aleksandar M.

“…•The highest cytotoxic activity in MRC5 fibroblasts and A375 melanoma was determined for 7,8-dihydroxy-4-phenyl coumarin.•SAR studies revealed the influence of…”
Get full text

Chemical characterization, in vitro biological activity of essential oils and extracts of three Eryngium L. species and molecular docking of selected major compounds by Matejić, Jelena S., Stojanović-Radić, Zorica Z., Ristić, Mihailo S., Veselinović, Jovana B., Zlatković, Bojan K., Marin, Petar D., Džamić, Ana M.

“…Many Eryngium species have been traditionally used as ornamental, edible or medicinal plants. The gas chromatography-flame ionization detector (GC-FID) and gas…”
Get full text

Monte Carlo Method-Based QSAR Modeling of Penicillins Binding to Human Serum Proteins by Veselinović, Jovana B., Toropov, Andrey A., Toropova, Alla P., Nikolić, Goran M., Veselinović, Aleksandar M.

“…The binding of penicillins to human serum proteins was modeled with optimal descriptors based on the Simplified Molecular Input‐Line Entry System (SMILES). The…”
Get full text

QSAR modeling of bis-quinolinium and bis-isoquinolinium compounds as acetylcholine esterase inhibitors based on the Monte Carlo method—the implication for Myasthenia gravis treatment by Sokolović, Dušan, Aleksić, Dragana, Milenković, Vesko, Karaleić, Sladjan, Mitić, Dragana, Kocić, Jadranka, Mekić, Branimir, Veselinović, Jovana B., Veselinović, Aleksandar M.

“…The Monte Carlo method was used for quantitative structure–activity relationship modeling of bis-quinolinium and bis-isoquinolinium compounds as acetylcholine…”
Get full text