Výsledky vyhledávání - "Moses M. Edim"

Akademický článek

Unraveling the impact of polar solvation on the molecular geometry, spectroscopy (FT-IR, UV, NMR), reactivity (ELF, NBO, HOMO-LUMO) and antiviral inhibitory potential of Cissampeline by molecular docking approach

Autor: Michael O. Odey, Ekpo E. Antai, Eze A. Adindu, Obinna C. Godfrey, Ini U. Bassey, Fransica O. Nwaokolrie, Ayodeji Owolabi, Ani Nkang, Terkumbur E. Gber, Moses M. Edim, Hitler Louis

Publikováno v: Chemical Physics Impact, Vol 7, Iss , Pp 100346- (2023)

Cissampeline, a highly promising natural substance derived from medicinal plants of the Cissampelos genus, has recently garnered significant interest due to its potent antiviral properties against a broad spectrum of viral infections. In this compreh

Externí odkaz: https://doaj.org/article/d2fd429aa05b439c889f8326cb1d4742

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Akademický článek

Quantum chemical studies, spectroscopic NMR and FT-IR analysis, and molecular docking investigation of 3,3′-di-O-methyl ellagic acid (DMA) as a potent Mycobacterium tuberculosis agent

Autor: Musa Runde, Mohammed H. Shagal, Anna Imojara, Elizabeth N. Mbim, Uwamere O. Edeghor, Moses M. Edim, Bernard C. Okoro, Amanda-Lee E. Manicum, Hitler Louis

Publikováno v: Results in Chemistry, Vol 6, Iss , Pp 101002- (2023)

Tuberculosis which is mainly caused by Mycobacterium tuberculosis remains of public health importance due to the resistance of the causative pathogen to the present antibiotics used as treatment options. This resistance has led to the need for the di

Externí odkaz: https://doaj.org/article/a8abae6ccd31403cbf30d895e98d8d34

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Akademický článek

Understanding the aqueous chemistry of quinoline and the diazanaphthalenes: insight from DFT study

Autor: Obieze C. Enudi, Hitler Louis, Moses M. Edim, John A. Agwupuye, Francis O. Ekpen, Emmanuel A. Bisong, Patrick M. Utsu

Publikováno v: Heliyon, Vol 7, Iss 7, Pp e07531- (2021)

The inter-fragment interactions at various binding sites and the overall cluster stability of quinolone (QNOL), cinnoline (CNOL), quinazoline (QNAZ), and quinoxaline (QNOX) complexes with H2O were studied using the density functional theory (DFT) app

Externí odkaz: https://doaj.org/article/754fe6d7a8e040a996905b43a1c95e1e

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Akademický článek

Aromaticity indices, electronic structural properties, and fuzzy atomic space investigations of naphthalene and its aza-derivatives

Autor: Moses M. Edim, Obieze C. Enudi, Bassey B. Asuquo, Hitler Louis, Emmanuel A. Bisong, John A. Agwupuye, Apebende G. Chioma, Joseph O. Odey, Innocent Joseph, Francisca I. Bassey

Publikováno v: Heliyon, Vol 7, Iss 2, Pp e06138- (2021)

The aromaticity and CDFT properties of naphthalene and its aza-derivatives were theoretically investigated using density functional theory (DFT) electronic structure method. The reactivity and chemistry of Azanaphthalene (1-AN), 1, 2-diazanaphthalene

Externí odkaz: https://doaj.org/article/fe05b7d40ac3468c8217014224ff3796

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Akademický článek

Vibrational, electronic, spectroscopic properties, and NBO analysis of p-xylene, 3,6-difluoro-p-xylene, 3,6-dichloro-p-xylene and 3,6-dibromo-pxylene: DFT study

Autor: Emmanuel A. Bisong, Hitler Louis, Tomsmith O. Unimuke, Joseph O. Odey, Emmanuel I. Ubana, Moses M. Edim, Fidelis Timothy Tizhe, John A. Agwupuye, Patrick M. Utsu

Publikováno v: Heliyon, Vol 6, Iss 12, Pp e05783- (2020)

This study explains the vibration and interaction of p-xylene and effect of three elements (fluorine, chlorine and bromine) of the halogen family substitution on it. Basic chemistry of four, compounds p-xylene (PX); 3,6-diflouro-p-xylene (DFPX); 3,6-

Externí odkaz: https://doaj.org/article/b978e865de0d4af8b2c554027182d457

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Kinetics Mechanism and Thermodynamic Study of the Oxidation of Iodide Ion by Dichromate Ion in Acidic Medium

Autor: B.J. Bassey, B.E. Nyong, O. A. Ushie, Moses M. Edim, F. E. Abeng

Publikováno v: Journal of Applied Sciences and Environmental Management. 24:821-826

This work introduces a newly developed kinetic mechanism and thermodynamic study that gives a clear theoretical insight between the iodine and chromium in acid solution. The paper mainly focuses on evaluating kinetic mechanism and thermodynamic prope

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::760672c676f05045a2b22853b473de7b
https://doi.org/10.4314/jasem.v24i5.14

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Understanding the aqueous chemistry of quinoline and the diazanaphthalenes: insight from DFT study

Autor: John A. Agwupuye, Patrick M. Utsu, Moses M. Edim, Obieze C. Enudi, Francis O. Ekpen, Hitler Louis, Emmanuel A. Bisong

Publikováno v: Heliyon, Vol 7, Iss 7, Pp e07531-(2021)
Heliyon

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::2f324a930571f17415c9dd4495ad79e5
http://www.sciencedirect.com/science/article/pii/S2405844021016340

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Electronic structure theory study of the reactivity and structural molecular properties of halo-substituted (F, Cl, Br) and heteroatom (N, O, S) doped cyclobutane

Autor: Obieze C. Enudi, Emmanuel I. Ubana, Tiyati H. Mujong, Apebende G. Chioma, Emmanuel A. Bisong, Asuquo B. Bassey, Hitler Louis, Queen O. Sam, Moses M. Edim, David Prince, Tomsmith O. Unimuke

Publikováno v: Physical Sciences Reviews.

Cyclobutane and its halo-substituted derivatives and its heteroatom doped derivatives have been extensively investigated in this study because of the vast applications and interesting chemistry associated with them, the vibrational assignments, Natur

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_________::b39035081be1e47d62d355bba3bdd70a
https://doi.org/10.1515/psr-2020-0138

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