Категорија DOI

Analysis of prediction of water solubility and lipophilicity of coumarins by free cheminformatics tools

2nd International Conference on Chemo and Bioinformatics ICCBIKG 2023 (657-661) АУТОР(И) / AUTHOR(S): Bešlo Drago, Agić Dejan, Rastija Vesna, Karnaš Maja, Šubarić Domagoj, Lučić Bono Е-АДРЕСА / E-MAIL: dbeslo@fazos.hr Download Full Pdf   DOI: 10.46793 САЖЕТАК / ABSTRACT: Pharmacokinetics of…

ДетаљнијеAnalysis of prediction of water solubility and lipophilicity of coumarins by free cheminformatics tools

Relativistic DFT calculation and their effect on the accuracy of results

2nd International Conference on Chemo and Bioinformatics ICCBIKG 2023 (653-656) АУТОР(И) / AUTHOR(S): Marko D. Radovanović, Ignjat Filipović, Maja Djukić, Marija Ristić, Matija Zlatar, Zoran D. Matović Е-АДРЕСА / E-MAIL: marko.radovanovic@pmf.kg.ac.rs Download Full Pdf   DOI: 10.46793 САЖЕТАК / ABSTRACT:…

ДетаљнијеRelativistic DFT calculation and their effect on the accuracy of results

Influence of Coordination on OH/π and NH/π Interactions

2nd International Conference on Chemo and Bioinformatics ICCBIKG 2023 (649-652) АУТОР(И) / AUTHOR(S): Jelena P. Blagojević Filipović, Dubravka Z. Vojislavljević-Vasilev, Snežana D. Zarić Е-АДРЕСА / E-MAIL: jbfilipovic@chem.bg.ac.rs Download Full Pdf   DOI: 10.46793 САЖЕТАК / ABSTRACT: The interactions of noncoordinated…

ДетаљнијеInfluence of Coordination on OH/π and NH/π Interactions

Stacking Interactions at Large Horizontal Displacements—Comparison of Various Ring Types

2nd International Conference on Chemo and Bioinformatics ICCBIKG 2023 (645-648) АУТОР(И) / AUTHOR(S): Jelena P. Blagojević Filipović, Dragan B. Ninković, Snežana D. Zarić Е-АДРЕСА / E-MAIL: jbfilipovic@chem.bg.ac.rs Download Full Pdf   DOI: 10.46793 САЖЕТАК / ABSTRACT: Noncovalent interactions at large…

ДетаљнијеStacking Interactions at Large Horizontal Displacements—Comparison of Various Ring Types

Computer-aided design of new drugs against breast cancer

2nd International Conference on Chemo and Bioinformatics ICCBIKG 2023 (641-644) АУТОР(И) / AUTHOR(S): Milan P. Mladenović, Nevena M. Tomašević, Sanja Lj. Matić, Tamara M. Mladenović, Rino Ragno Е-АДРЕСА / E-MAIL: milan.mladenovic@pmf.kg.ac.rs Download Full Pdf   DOI: 10.46793 САЖЕТАК / ABSTRACT:…

ДетаљнијеComputer-aided design of new drugs against breast cancer

Repulsive water-water contacts from Cambridge Structural Database

2nd International Conference on Chemo and Bioinformatics ICCBIKG 2023 (637-640) АУТОР(И) / AUTHOR(S): Milan R. Milovanović, Jelena M. Živković, Ivana M. Stanković, Dragan B. Ninković, Snežana D. Zarić Е-АДРЕСА / E-MAIL: milovanovic@chem.bg.ac.rs Download Full Pdf   DOI: 10.46793 САЖЕТАК /…

ДетаљнијеRepulsive water-water contacts from Cambridge Structural Database

Noncovalent interactions of halogen atoms in halogenated bipyridines

2nd International Conference on Chemo and Bioinformatics ICCBIKG 2023 (633-636) АУТОР(И) / AUTHOR(S): Bogdan K. Pantelić, Snežana D. Zarić, Jelena M. Živković Е-АДРЕСА / E-MAIL: szaric@chem.bg.ac.rs Download Full Pdf   DOI: 10.46793 САЖЕТАК / ABSTRACT: Noncovalent interactions of halogen atoms…

ДетаљнијеNoncovalent interactions of halogen atoms in halogenated bipyridines

Computational study on the interactions of quercetin 3-O-rutinoside with human DPP III

2nd International Conference on Chemo and Bioinformatics ICCBIKG 2023 (629-632) АУТОР(И) / AUTHOR(S): Dejan Agić, Drago Bešlo, Bono Lučić, Sanja Tomić, Bojana Blagojević, Boris M. Popović Е-АДРЕСА / E-MAIL: dagic@fazos.hr Download Full Pdf   DOI: 10.46793 САЖЕТАК / ABSTRACT: Human…

ДетаљнијеComputational study on the interactions of quercetin 3-O-rutinoside with human DPP III

Substituent effects on stacking interactions of aromatic ligands in organometallic compounds – chemoinformatics and quantum chemical study

2nd International Conference on Chemo and Bioinformatics ICCBIKG 2023 (625-628) АУТОР(И) / AUTHOR(S): Dušan P. Malenov, Jelena P. Blagojević Filipović, Snežana D. Zarić Е-АДРЕСА / E-MAIL: malenov@chem.bg.ac.rs Download Full Pdf   DOI: 10.46793 САЖЕТАК / ABSTRACT: The effects of alkyl…

ДетаљнијеSubstituent effects on stacking interactions of aromatic ligands in organometallic compounds – chemoinformatics and quantum chemical study

Modeling ion-π interactions of transition metal complexes

2nd International Conference on Chemo and Bioinformatics ICCBIKG 2023 (621-624) АУТОР(И) / AUTHOR(S): Dušan P. Malenov, Katarina A. Ćeranić, Dubravka Z. Vojislavljević-Vasilev, Snežana D. Zarić Е-АДРЕСА / E-MAIL: malenov@chem.bg.ac.rs Download Full Pdf   DOI: 10.46793 САЖЕТАК / ABSTRACT: Interactions of…

ДетаљнијеModeling ion-π interactions of transition metal complexes