Experimental FT-IR and UV–Vis spectroscopic studies and molecular docking analysis of anti-cancer drugs Exemestane and Pazopanib
Cancer is the world's third leading cause of mortality, after only cardiovascular disease,
parasitic infection, and infectious disease, according to the World Health Organization …
parasitic infection, and infectious disease, according to the World Health Organization …
Experimental (FT-IR, UV-Vis) spectroscopic analysis and molecular docking investigations of anti-cancer drugs Alkeran and Bicalutamide
PV Ramana, YR Krishna, KC Mouli - Journal of Molecular Structure, 2022 - Elsevier
Abstract According to the World Health Organization reports, cancer is the leading cause of
death around the globe. Infectious diseases, parasitic infections, and cardiovascular …
death around the globe. Infectious diseases, parasitic infections, and cardiovascular …
[PDF][PDF] Molecular structure, homo-lumo analysis and vibrational spectroscopy of the cancer healing pro-drug temozolomide based on dft calculations
R Rijal, HP Lamichhane, K Pudasainee - AIMS Biophys, 2022 - aimspress.com
Molecular structure, homo-lumo analysis and vibrational spectroscopy of the cancer healing
pro-drug temozolomide based on dft ca Page 1 AIMS Biophysics, 9(3): 208–220. DOI …
pro-drug temozolomide based on dft ca Page 1 AIMS Biophysics, 9(3): 208–220. DOI …
A review on medicinally important heterocyclic compounds and importance of biophysical approach of underlying the insight mechanism in biological environment
Heterocyclic derivatives have more interesting biological properties which hold a
remarkable place in pharmaceutical industries due to their unique physiochemical …
remarkable place in pharmaceutical industries due to their unique physiochemical …
Molecular structure, vibrational spectroscopic analysis (IR & Raman), HOMO-LUMO and NBO analysis of anti-cancer drug sunitinib using DFT method
Ö Mıhçıokur, T Özpozan - Journal of Molecular Structure, 2017 - Elsevier
Oxindole and its derivatives have wide applications in different industries such as in
synthetic & natural fibers, dyes for hair and plastic materials in addition to their biological …
synthetic & natural fibers, dyes for hair and plastic materials in addition to their biological …
Quantum Computational, Spectroscopic (FT-IR, FT-Raman, NMR, and UV–Vis) Hirshfeld Surface and Molecular Docking-Dynamics Studies on 5-Hydroxymethyluracil …
For many decades, uracil has been an antineoplastic agent used in combination with tegafur
to treat various human cancers, including breast, prostate, and liver cancer. Therefore, it is …
to treat various human cancers, including breast, prostate, and liver cancer. Therefore, it is …
Molecular structure, vibrational spectroscopic, frontier molecular orbital and natural bond orbital analysis of anti-cancer drug 6-chloro-3-pyridine carbonitrile
G Golding Sheeba, D Usha, M Amalanathan… - Spectroscopy …, 2021 - Taylor & Francis
The optimized parameters, the vibrational wavenumbers of 6-chloro-3-Pyridinecarbonitrile
were determined by utilizing density functional method. Vibrational task of the molecule was …
were determined by utilizing density functional method. Vibrational task of the molecule was …
Molecular geometry, vibrational spectra, atomic charges, frontier molecular orbital and Fukui function analysis of antiviral drug zidovudine
GR Ramkumaar, S Srinivasan, TJ Bhoopathy… - … Acta Part A: Molecular …, 2012 - Elsevier
The solid phase FT-IR and FT-Raman spectra of zidovudine (AZT) were recorded in the
regions 4000–400 and 3500–100cm− 1, respectively. The optimized geometry, frequency …
regions 4000–400 and 3500–100cm− 1, respectively. The optimized geometry, frequency …
The spectroscopic properties of anticancer drug Apigenin investigated by using DFT calculations, FT-IR, FT-Raman and NMR analysis
G Mariappan, N Sundaraganesan… - Spectrochimica Acta Part …, 2012 - Elsevier
The FT-Raman and FT-Infrared spectra of solid Apigenin sample were measured in order to
elucidate the spectroscopic properties of title molecule in the spectral range of 3500–50cm …
elucidate the spectroscopic properties of title molecule in the spectral range of 3500–50cm …
Spectral, DFT/B3LYP and molecular docking analyses on ethyl 2-(5-methyl-1, 2, 4-triazolo [1, 5-a] pyrimidin-7-yl) pent-4-enoate
In this paper, the compound ethyl 2-(5-methyl-1, 2, 4-triazolo [1, 5-a] pyrimidin-7-yl) pent-4-
enoate was synthesized and identified by FT-IR, 1 H and 13 C NMR, UV–Vis. And single …
enoate was synthesized and identified by FT-IR, 1 H and 13 C NMR, UV–Vis. And single …
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