Работы, на которые ссылается эта работа

Работ: 62

Работа: Solvents and their influence on electronic properties in IEFPCM solvation model, anticancer activity, and docking studies on (E)-2-((4-chlorobenzylidene) amino)phenol

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ABI
Hydrogen bonds interactions in biuret-water clusters: FTIR, X-ray diffraction, AIM, DFT, RDG, ELF, NLO analysis
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Vibrational Energy Distribution Analysis (VEDA): Scopes and limitations
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ABI
Interaction Region Indicator: A Simple Real Space Function Clearly Revealing Both Chemical Bonds and Weak Interactions**
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ABI
Spectroscopic and quantum chemical computation on molecular structure, AIM, ELF, RDG, NCI, and NLO activity of 4-VINYL benzoic acid: A DFT approach
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ABI
Synthesis, spectroscopic, quantum computation, electronic, AIM, Wavefunction (ELF, LOL) and Molecular Docking investigation on (E)-1-(2,5-dichlorothiophen-3-yl)-3-(thiophen-2-yl)-2-propen-1-one
S. Sangeetha Margreat, S. Ramalingam, Helmi Mohammed Al‐Maqtari +4
Статья2021Цитирований: 5
ABI
Solvent role in molecular structure level, structural and topology investigations, molecular docking and antimicrobial activity studies on sulpha drug derivative
N. Elangovan, Natarajan Arumugam
Статья2024Цитирований: 5
ABI
Quantum computational, spectroscopic investigations on N-(2-((2-chloro-4,5-dicyanophenyl)amino)ethyl)-4-methylbenzenesulfonamide by DFT/TD-DFT with different solvents, molecular docking and drug-likeness researches
Necmi Dege, Halil Gökçe, Onur Erman Doĝan +4
Статья2022Цитирований: 4
ABI
Eco-friendly synthesis, characterization, in-silico ADMET and molecular docking analysis of novel carbazole derivatives as antibacterial and antifungal agents
Oussama Merzouki, N. Arrousse, Azeddin El Barnossi +5
Статья2022Цитирований: 4
ABI
Discovery of sulfadrug–pyrrole conjugates as carbonic anhydrase and acetylcholinesterase inhibitors
Mehmet Gümüş, Şemsi N. Babacan, Yeliz Demir +3
Статья2021Цитирований: 4
ABI
Speculative assessment, molecular composition, PDOS, topology exploration (ELF, LOL, RDG), ligand-protein interactions, on 5-bromo-3-nitropyridine-2-carbonitrile
K. Arulaabaranam, S. Muthu, G. Mani +1
Статья2021Цитирований: 4
ABI
A combined experimental and quantum chemical study on molecular structure, spectroscopic properties and biological activity of anti-inflammatory Glucocorticosteroid drug, Dexamethasone
S. J. Soumya, I. Hubert Joe
Статья2021Цитирований: 4
ABI
Structural insights, spectral, flourescence, Z-scan, C-H…O/N-H…O hydrogen bonding and AIM, RDG, ELF, LOL, FUKUI analysis, NLO activity of N-2(Methoxy phenyl) acetamide
M. Jini Pramila, D. Arul Dhas, I. Hubert Joe +2
Статья2022Цитирований: 4
ABI
DORI Reveals the Influence of Noncovalent Interactions on Covalent Bonding Patterns in Molecular Crystals Under Pressure
Benjamin Meyer, Senja Barthel, Amber Mace +4
Статья2019Цитирований: 3
ABI
Synthesis, solvent role (water and DMSO), antimicrobial activity, reactivity analysis, inter and intramolecular charge transfer, topology, and molecular docking studies on adenine derivative
N. Elangovan, S. Sowrirajan, Natarajan Arumugam +3
Статья2023Цитирований: 3
ABI
RETRACTED: Synthesis, solvent role, absorption and emission studies of cytosine derivative
N. Elangovan, Natarajan Arumugam, Abdulrahman I. Almansour +4
Статья2024Цитирований: 3
ABI
Structural, Spectral, Pharmacokinetics Analysis (in-Silico), Drug-Likeness, NCI Analysis (ELF, LOL, IRI & DORI) & Molecular Docking Computations of 2-Hydroxy 2-Phenyl Acetophenone a DFT Approaches
S. Mallika, N. Thirughanasambantham, B.K. Revathi +3
Статья2024Цитирований: 3
ABI
Synthesis and spectral characterization of some metal complexes with new heterocyclic azo imidazole dye ligand and study biological activity as anticancer
Dunya Yousif Fnfoon, Khalid J. Al-Adilee
Статья2022Цитирований: 2
ABI
Quantum Computational Investigation of (E)-1-(4-methoxyphenyl)-5-methyl-N′-(3-phenoxybenzylidene)-1H-1,2,3-triazole-4-carbohydrazide
Halil Gökçe, Fatih Şen, Yusuf Sert +3
Статья2022Цитирований: 2
ABI
Synthesis, structural investigation, computational study, antimicrobial activity and molecular docking studies of novel synthesized (E)-4-((pyridine-4-ylmethylene)amino)-N-(pyrimidin-2-yl)benzenesulfonamide from pyridine-4-carboxaldehyde and sulfadiazine
N. Elangovan, S. Sowrirajan, K. Manoj +1
Статья2021Цитирований: 2
ABI
Synthesis, characterization and self-assembly of new cholesteryl-substitued sym-tetrazine: Fluorescence, gelation and mesogenic properties
Amerah Alsoliemy, Abdulmajeed F. Alrefaei, Samah J. Almehmadi +4
Статья2021Цитирований: 2
ABI
Synthesis and characterization of the fluorescence utility of two Visible-Light-Absorbing tryptophan derivatives
Robert J. Micikas, Arusha Acharyya, Amos B. Smith +1
Статья2022Цитирований: 2
ABI
Synthesis, antimicrobial evaluation, crystal structure, Hirschfeld surface analysis and docking studies of 4-[2-(1-methyl-1H-imidazol-2-ylsulfanyl)-acetylamino]-benzenesulfonic acid
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Статья2022Цитирований: 2
ABI
Novel α-aminophosphonate derivates synthesis, theoretical calculation, Molecular docking, and in silico prediction of potential inhibition of SARS-CoV-2
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ABI
Synthesis, biological evaluation, and molecular docking studies of novel diclofenac derivatives as antibacterial agents
Mahmoud M. Hamed, Mostafa Sayed, Shawkat A. Abdel‐Mohsen +4
Статья2022Цитирований: 2
ABI