Synthesis and characterization of Zinc(II) complex with ONO donor type new Phenylpropanehydrazide based ligand: Crystal Structure, Hirshfeld Surface Analysis, DFT, Energy Frameworks and Molecular Docking

Journal of Molecular Structure ◽

10.1016/j.molstruc.2022.132429 ◽

2022 ◽

pp. 132429

Author(s):

M.N. Somashekar ◽

P.R. Chetana ◽

B.S. Chethan ◽

H.R. Rajegowda ◽

M.A. Cooper ◽

...

Keyword(s):

Crystal Structure ◽

Molecular Docking ◽

Surface Analysis ◽

Hirshfeld Surface ◽

Hirshfeld Surface Analysis ◽

Synthesis And Characterization ◽

Donor Type

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Synthesis, crystal structure, Hirshfeld surface analysis and characterization of a new Cd(II) complex with the 4,4’-dimethyl-2,2’-dipyridine monodentate ligand

Journal of the Iranian Chemical Society ◽

10.1007/s13738-021-02308-7 ◽

2021 ◽

Author(s):

Kacem Klai ◽

Christian Jelsch ◽

Emmanuel Wenger ◽

Frederic Lefebvre ◽

Cherif Ben Nasr ◽

...

Keyword(s):

Crystal Structure ◽

Surface Analysis ◽

Hirshfeld Surface ◽

Hirshfeld Surface Analysis ◽

Monodentate Ligand

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Synthesis and characterization of zinc(II) complexes with new pyridine-based ligands: crystal structure, Hirshfeld surface analysis, and molecular docking study of lung cancer cell

Journal of Coordination Chemistry ◽

10.1080/00958972.2020.1853710 ◽

2020 ◽

Vol 73 (23) ◽

pp. 3203-3222

Author(s):

Tufan Topal

Keyword(s):

Crystal Structure ◽

Lung Cancer ◽

Molecular Docking ◽

Cancer Cell ◽

Docking Study ◽

Hirshfeld Surface ◽

Synthesis And Characterization ◽

Lung Cancer Cell ◽

Molecular Docking Study

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Synthesis, crystal structure, spectroscopic characterization, Hirshfeld surface analysis, molecular docking studies and DFT calculations, and antioxidant activity of 2-oxo-1,2-dihydroquinoline-4-carboxylate derivatives

Journal of Molecular Structure ◽

10.1016/j.molstruc.2019.03.103 ◽

2019 ◽

Vol 1188 ◽

pp. 255-268 ◽

Cited By ~ 11

Author(s):

Yassir Filali Baba ◽

Yusuf Sert ◽

Youssef Kandri Rodi ◽

Sonia Hayani ◽

Joel T. Mague ◽

...

Keyword(s):

Crystal Structure ◽

Antioxidant Activity ◽

Molecular Docking ◽

Dft Calculations ◽

Surface Analysis ◽

Spectroscopic Characterization ◽

Docking Studies ◽

Hirshfeld Surface ◽

Hirshfeld Surface Analysis ◽

Molecular Docking Studies

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Crystal structure, Hirshfeld surface analysis, DFT calculations and molecular docking studies on pyridine derivatives as potential inhibitors of NAMPT

Chemical Data Collections ◽

10.1016/j.cdc.2019.100262 ◽

2019 ◽

Vol 23 ◽

pp. 100262

Author(s):

M. Venkateshan ◽

R. Vishnu Priya ◽

M. Muthu ◽

J. Suresh ◽

R. Ranjith Kumar

Keyword(s):

Crystal Structure ◽

Molecular Docking ◽

Dft Calculations ◽

Surface Analysis ◽

Docking Studies ◽

Hirshfeld Surface ◽

Hirshfeld Surface Analysis ◽

Pyridine Derivatives ◽

Molecular Docking Studies ◽

Potential Inhibitors

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Crystal structure, Hirshfeld surface analysis, DFT and molecular docking studies on benzohydrazide derivatives as potential inhibitors of prostate cancer

Chemical Data Collections ◽

10.1016/j.cdc.2020.100350 ◽

2020 ◽

Vol 26 ◽

pp. 100350

Author(s):

H.A. Arjun ◽

Ravi Kumar Rajan ◽

R. Elancheran ◽

M. Ramanathan ◽

Atanu Bhattacharjee ◽

...

Keyword(s):

Crystal Structure ◽

Prostate Cancer ◽

Molecular Docking ◽

Surface Analysis ◽

Docking Studies ◽

Hirshfeld Surface ◽

Hirshfeld Surface Analysis ◽

Molecular Docking Studies ◽

Potential Inhibitors

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A Hirshfeld surface analysis, crystal structure and infrared characterization of a new organic cyclohexaphosphate, (C8H12N)4(Li)2(P6O18)(H2O)6

Journal of Molecular Structure ◽

10.1016/j.molstruc.2017.01.035 ◽

2017 ◽

Vol 1134 ◽

pp. 828-834 ◽

Cited By ~ 4

Author(s):

L. Khedhiri ◽

V. Ferretti ◽

C. Jelsch ◽

M. Rzaigui ◽

C. Ben Nasr

Keyword(s):

Crystal Structure ◽

Surface Analysis ◽

Hirshfeld Surface ◽

Hirshfeld Surface Analysis

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New Tetrazoles compounds Incorporating Galactose moiety: synthesis, crystal structure, spectroscopic characterization, Hirshfeld surface analysis, molecular docking studies, DFT calculations and anti-corrosion property anticipation

Journal of Molecular Structure ◽

10.1016/j.molstruc.2021.131300 ◽

2021 ◽

pp. 131300

Author(s):

Riham Sghyar ◽

Yusuf Sert ◽

Brahim El Ibrahimi ◽

Oussama Moussaoui ◽

El Mestafa EL Hadrami ◽

...

Keyword(s):

Crystal Structure ◽

Molecular Docking ◽

Dft Calculations ◽

Surface Analysis ◽

Spectroscopic Characterization ◽

Docking Studies ◽

Corrosion Property ◽

Hirshfeld Surface ◽

Hirshfeld Surface Analysis ◽

Molecular Docking Studies

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N-{2-[(2-chlorothieno[3,2-d]pyrimidin-4-yl)amino]ethyl}-3-methoxybenzamide: design, synthesis, crystal structure, antiproliferative activity, DFT, Hirshfeld surface analysis and molecular docking study

Journal of Biomolecular Structure and Dynamics ◽

10.1080/07391102.2020.1819424 ◽

2020 ◽

pp. 1-9

Author(s):

Pei Huang ◽

Juan Zhao ◽

Yan-Hong Gao ◽

Ling-Xia Jin ◽

Qin Wang ◽

...

Keyword(s):

Crystal Structure ◽

Molecular Docking ◽

Surface Analysis ◽

Antiproliferative Activity ◽

Docking Study ◽

Hirshfeld Surface ◽

Hirshfeld Surface Analysis ◽

Molecular Docking Study ◽

Design Synthesis

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New alkyl (cyclohexyl) 2-oxo-1-(prop‑2-yn-1-yl)-1, 2-dihydroquinoline-4-carboxylates: Synthesis, crystal structure, spectroscopic characterization, hirshfeld surface analysis, molecular docking studies and DFT calculations

Journal of Molecular Structure ◽

10.1016/j.molstruc.2020.129520 ◽

2021 ◽

Vol 1227 ◽

pp. 129520

Author(s):

Sonia Hayani ◽

Yusuf Sert ◽

Yassir Filali Baba ◽

Fouad Benhiba ◽

Fouad Ouazzani Chahdi ◽

...

Keyword(s):

Crystal Structure ◽

Molecular Docking ◽

Dft Calculations ◽

Surface Analysis ◽

Spectroscopic Characterization ◽

Docking Studies ◽

Hirshfeld Surface ◽

Hirshfeld Surface Analysis ◽

Molecular Docking Studies

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Crystal structure, Hirshfeld surface analysis, and molecular docking studies of 3,3′-((4-(trifluoromethyl)phenyl) methylene)bis(1-methyl-1H-indole)

Molecular Crystals and Liquid Crystals ◽

10.1080/15421406.2020.1852747 ◽

2021 ◽

Vol 714 (1) ◽

pp. 67-79

Author(s):

Varun Sharma ◽

Sanchari Begam ◽

Indrajit Karmakar ◽

Goutam Brahmachari ◽

Vivek Kumar Gupta

Keyword(s):

Crystal Structure ◽

Molecular Docking ◽

Surface Analysis ◽

Docking Studies ◽

Hirshfeld Surface ◽

Hirshfeld Surface Analysis ◽

Molecular Docking Studies

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