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#TitleJournalYearCitations
1DFT study of linear and nonlinear optical properties of donor-acceptor substituted stilbenes, azobenzenes and benzilideneanilinesJournal of Molecular Modeling201053
2Application of a computational model of natural deep eutectic solvents utilizing the COSMO-RS approach for screening of solvents with high solubility of rutinJournal of Molecular Modeling201842
3A post-SCF complete basis set study on the recognition patterns of uracil and cytosine by aromatic and π–aromatic stacking interactions with amino acid residuesPhysical Chemistry Chemical Physics200837
4Synthesis and Linear and Nonlinear Optical Properties of Three Push–Pull Oxazol-5(4H)-one CompoundsJournal of Organic Chemistry201536
5Styryl dye possessing donor-π-acceptor structure – Synthesis, spectroscopic and computational studiesDyes and Pigments201333
6Time-dependent density functional theory calculations of the solvatochromism of some azo sulfonamide fluorochromesJournal of Molecular Modeling201533
7Nanotechnology, from quantum mechanical calculations up to drug deliveryInternational Journal of Nanomedicine201833
8A review of the innovative gas separation membrane bioreactor with mechanisms for integrated production and purification of biohydrogenBioresource Technology201833
9Hydrolytic degradation of copolymers based on l-lactic acid and bis-2-hydroxyethyl terephthalatePolymer Degradation and Stability200732
10Formation of chlorinated breakdown products during degradation of sunscreen agent, 2-ethylhexyl-4-methoxycinnamate in the presence of sodium hypochloriteEnvironmental Science and Pollution Research201630
11The MP2 quantum chemistry study on the local minima of guanine stacked with all four nucleic acid bases in conformations corresponding to mean B-DNAComputational and Theoretical Chemistry200529
12Silicon dioxide surface modified with cholesterol derivativesMaterials Chemistry and Physics200128
13On the influence of confinement effects on electric properties: An ab initio studyChemical Physics Letters200728
14Environment influences on the aromatic character of nucleobases and amino acidsJournal of Molecular Modeling201027
15Experimental and theoretical studies of the influence of solvent polarity on the spectral properties of two push-pull oxazol-5-(4 H )-one compoundsSpectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy201727
16The nature of interactions in uracil dimer: An ab initio studyChemical Physics Letters200726
17The post-SCF quantum chemistry characteristics of the guanine–guanine stacking B-DNAPhysical Chemistry Chemical Physics200826
18Color prediction from first principle quantum chemistry computations: a case of alizarin dissolved in methanolNew Journal of Chemistry201226
19The effect of primers on adhesive properties and strength of adhesive joints made with polyurethane adhesivesJournal of Adhesion Science and Technology201726
20New insights into the ideal adsorbed solution theoryPhysical Chemistry Chemical Physics201525
21Spectroscopic and nonlinear optical properties of new chalcone fluorescent probes for bioimaging applications: a theoretical and experimental studyJournal of Molecular Modeling201625
22Linear and nonlinear optical properties of azobenzene derivativesJournal of Molecular Modeling200924
23Solubility advantage of sulfanilamide and sulfacetamide in natural deep eutectic systems: experimental and theoretical investigationsDrug Development and Industrial Pharmacy201924
24Investigation of selected properties of adhesive compositions based on epoxy resinsInternational Journal of Adhesion and Adhesives201922
25Membrane transport of organics. II. Permeation of some carboxylic acids through strongly basic polymer membraneJournal of Applied Polymer Science199921
26Screening of ionic liquids for efficient extraction of methylxanthines using COSMO-RS methodologyChemical Engineering Research and Design201721
27Synthesis, photophysical properties and systematic evaluations of new phenanthroimidazole fluorescent probe for bioimaging: Experimental and theoretical studyJournal of Photochemistry and Photobiology B: Biology201721
28Nanotube junctions and the genus of multi-toriPhysical Chemistry Chemical Physics201220
29Propensity of salicylamide and ethenzamide cocrystallization with aromatic carboxylic acidsEuropean Journal of Pharmaceutical Sciences201620
30Possibilities for the biologically-assisted utilization of CO2-rich gaseous waste streams generated during membrane technological separation of biohydrogenJournal of CO2 Utilization202020
31Exploring the cocrystallization potential of urea and benzamideJournal of Molecular Modeling201619
32Solubility of sulfanilamide in binary solvents containing water: Measurements and prediction using Buchowski-Ksiazczak solubility modelJournal of Molecular Liquids202019
33Solvent Screening for Solubility Enhancement of Theophylline in Neat, Binary and Ternary NADES Solvents: New Measurements and Ensemble Machine LearningInternational Journal of Molecular Sciences202119
34Membrane transport of organics. I. Sorption and permeation of carboxylic acids in perfluorosulfonic and perfluorocarboxylic polymer membranesJournal of Applied Polymer Science199718
35On the origin of surface imposed anisotropic growth of salicylic and acetylsalicylic acids crystals during droplet evaporationJournal of Molecular Modeling201518
36Experimental and theoretical investigations of spectroscopic properties of azobenzene derivatives in solutionJournal of Molecular Modeling200717
37Two-dimensional gas and vacancy solution approaches in the thermodynamic description of adsorption equilibriumJournal of Colloid and Interface Science200516
38Synthesis, structural study and hydrolytic degradation of copolymer based on glycolic acid and bis-2-hydroxyethyl terephthalatePolymer Degradation and Stability200916
39Molecular dynamics study on inhibition mechanism of CDK-2 and GSK-3β by CHEMBL272026 moleculeStructural Chemistry201616
40Utilization of oriented crystal growth for screening of aromatic carboxylic acids cocrystallization with ureaJournal of Crystal Growth201616
41In silico screening of dicarboxylic acids for cocrystallization with phenylpiperazine derivatives based on both cocrystallization propensity and solubility advantageJournal of Molecular Modeling201716
42Synthesis, spectroscopic, physicochemical properties and binding site analysis of 4-(1H-phenanthro[9,10-d]-imidazol-2-yl)-benzaldehyde fluorescent probe for imaging in cell biology: Experimental and theoretical studyJournal of Photochemistry and Photobiology B: Biology201615
43Thermodynamics and Intermolecular Interactions of Nicotinamide in Neat and Binary Solutions: Experimental Measurements and COSMO-RS Concentration Dependent Reactions InvestigationsInternational Journal of Molecular Sciences202115
44Membrane transport of organics. III. Permeation of some carboxylic acids through bipolar polymer membraneJournal of Applied Polymer Science200114
45Computational insight into relations between electronic and vibrational polarizabilities within the two-state valence-bond charge-transfer modelChemical Physics200714
46Synthesis and photophysical properties of two-photon chromophores containing 1H-benzimidazole residueDyes and Pigments201414
47On the origin of surfaces-dependent growth of benzoic acid crystal inferred through the droplet evaporation methodStructural Chemistry201514
48Ozonization of electronic conducting polymers: II. Degradation or dopingPolymer Degradation and Stability200613
49Influence of thermal vibrations on aromaticity of benzenePhysical Chemistry Chemical Physics201113
50Experimental and Theoretical Screening for Green Solvents Improving Sulfamethizole SolubilityMaterials202113