754 results on '"Safin, Damir A."'
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2. OpenSBT: A Modular Framework for Search-based Testing of Automated Driving Systems
3. Reflections on Surrogate-Assisted Search-Based Testing: A Taxonomy and Two Replication Studies based on Industrial ADAS and Simulink Models
4. Computational studies of closely related 2-cyanopyrimidine, pyrimidine-2-carboximidamide and 2,4,6-tris(2-pyrimidyl)-1,3,5-triazine with a potency against SARS-CoV-2
5. Mono- versus bifunctionalized Schiff base as a condensation product of m-phenylenediamine and salicylaldehyde: experimental and computational studies
6. A pyrazinamide-benzenesulfonohydrazide hybrid N'-(phenylsulfonyl)pyrazine-2-carbohydrazonamide: Experimental and theoretical insights
7. Zinc(II) coordination compound with N′-(pyridin-2-ylmethylene)nicotinohydrazide: Synthesis, crystal structure, computational and cytotoxicity studies
8. Methyl- versus ethyl-directed formation of square-planar Cobalt(II) and octahedral Cobalt(III) chelates of the in situ generated Schiff bases
9. In silico analyses of betulin: DFT studies, corrosion inhibition properties, ADMET prediction, and molecular docking with a series of SARS-CoV-2 and monkeypox proteins
10. Combined DFT and Monte Carlo simulation studies of potential corrosion inhibition properties of heterocyclic derivatives with an extended π-System
11. Elucidating elusive quaternary selenide EuCeCuSe3: Synthesis, crystal structure, properties and theoretical studies
12. DFT, ADMET, molecular docking and molecular dynamics studies of pyridoxal
13. N'-isonicotinoylpicolinohydrazonamide: synthesis, crystal structure, DFT and ADMET studies, and in silico inhibition properties toward a series of COVID-19 proteins
14. Description of the acid–base equilibria on the 8-hydroxyquinoline-modified silica surface using surface complexation theory
15. A novel coumarin-triazole-thiophene hybrid: synthesis, characterization, ADMET prediction, molecular docking and molecular dynamics studies with a series of SARS-CoV-2 proteins
16. OpenSBT: A Modular Framework for Search-based Testing of Automated Driving Systems
17. First-principles calculations to investigate optical, phonon and electronic properties of quaternary sulfides SRECuS3 (RE = La, Nd, Tm)
18. Ligand-dictated planar versus bent nickel(II) chelates of the Schiff bases: Synthesis, crystal structures, optical properties, DFT and molecular docking studies
19. Naphthalene-based bis-N-salicylidene aniline dyes: Crystal structures, Hirshfeld surface analysis, computational study and molecular docking with the SARS-CoV-2 proteins
20. Supramolecular aggregation of lead(II) perchlorate and a thiosemicarbazide derivative linked by a myriad of non-covalent interactions
21. Favipiravir: insight into the crystal structure, Hirshfeld surface analysis and computational study
22. In silico studies of 6-phenyl-3-(pyridin-2-yl)-1,2,4-triazine as a corrosion inhibitor for some important metals used in implants
23. Spodium bonds and metal–halogen···halogen–metal interactions in propagation of monomeric units to dimeric or polymeric architectures
24. A readily available structural analogue of integrastatins A and B: Insight into the crystal structure, Hirshfeld surface analysis and computational study
25. Computational analysis of aspirin
26. Crystal structure, quantum computational, molecular docking and in vitro anti-proliferative investigations of 1H‐imidazole‐2‐thione analogues derivative
27. Aerial carbon dioxide conversion to carbonate mediated by a lead(II) complex with tridentate bipyridine containing a hydrazide ligand under electrochemical conditions yielding single-component white-light-emitting phosphors.
28. Anion driven tetrel bonding dictated supramolecular architectures of lead(II) with a zwitterionic form of polydentate N′-(piperidine-1-carbonothioyl)picolinohydrazonamide.
29. A lead(II)–N′-isonicotinoylpyrazine-2-carbohydrazonamide complex system as a converter of aerial carbon dioxide to carbonate under electrochemical conditions with the formation of a single-component white light-emitting phosphor.
30. A chiral (1R,2R)-N,N′-bis-(salicylidene)-1,2-diphenyl-1,2-ethanediamine Schiff base dye: synthesis, crystal structure, Hirshfeld surface analysis, computational study, photophysical properties and in silico antifungal activity
31. Green Approaches for Efficient Functional Group Analysis of Organic Compounds
32. Photo- and X-ray Induced Cytotoxicity of CeF3-YF3-TbF3 Nanoparticle-Polyvinylpyrrolidone—“Radachlorin” Composites for Combined Photodynamic Therapy
33. An extended supramolecular coordination compound produced from PbCl2 and N'-isonicotinoylpicolinohydrazonamide
34. Preparation of Multicomponent Oxide Charges for the Synthesis of Rare Earth Layered Selenides
35. On the pivotal role of tetrel bonding in the supramolecular architectures of Pb(II)–NCS complexes with chelating thiosemicarbazide derivatives
36. Evaluation of the antitumor activity of a series of the pincer-type metallocomplexes produced from isonicotinohydrazide derivative
37. Novel sterically demanding Schiff base dyes: An insight from experimental and theoretical calculations
38. α-Aminophosphonates 4-XC6H4–NH–CH(4-BrC6H4)–P(O)(OiPr)2 (X = H, Br, MeO): Crystal structures, Hirshfeld surface analysis, computational studies and in silico molecular docking with the SARS-CoV-2 proteins
39. A novel paramagnetic coordination polymer, fabricated from Co(NCS)2 and 2-pyridinecarbaldehyde isonicotinoylhydrazone
40. A new coordination polymer constructed from Pb(NO3)2 and a benzylideneisonicotinohydrazide derivative: Coordination-induced generation of a π-hole towards a tetrel-bonding stabilized structure
41. Zinc(II) complexes derived from 2-formylpyridine nicotinoyl hydrazone as organic blocker: Syntheses, crystal architectures, Hirshfeld surface analyses and DFT studies
42. Ligand structure-driven self-assembly of Zn(NCS)2 with a carbohydrazone ligand: A possible intermediate towards a [2 × 2] metallic grid
43. A supramolecular 3D structure constructed from a new metal chelate self-assembled from Sn(NCS)2 and phenyl(pyridin-2-yl)methylenepicolinohydrazide
44. Supramolecular architectures of Mn(NCS)2 complexes with N'-(1-(pyridin-4-yl)ethylidene)picolinohydrazide and N'-(phenyl(pyridin-4-yl)methylene)isonicotinohydrazide
45. Photophysical properties of ethyl N-(5-bromosalicylidene)glycinate and ethyl N-(5-nitrosalicylidene)glycinate in CH2Cl2
46. Experimental and Theoretical Insights on the Structural, Electronic, and Magnetic Properties of the Quaternary Selenides EuPrCuSe3 and EuNdCuSe3.
47. Novel lanthanide(III) complex [LaL2(NO3) (H2O)2]·5H2O with 2-pyridine carboxaldehyde isonicotinoyl hydrazine exhibiting a 3D supramolecular topology 3,6T49
48. Computational studies of closely related 2-cyanopyrimidine, pyrimidine-2-carboximidamide and 2,4,6-tris(2-pyrimidyl)-1,3,5-triazine with a potency against SARS-CoV-2
49. Reflections on Surrogate-Assisted Search-Based Testing: A Taxonomy and Two Replication Studies based on Industrial ADAS and Simulink Models
50. Novel 1,2,4-triazolethiol–thiophen Hybrids: Facile Synthesis, Characterization, ADMET Prediction and Molecular Docking
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