[HTML][HTML] Investigating the potential of thiazolyl carbohydrazides derivatives as anti-Candida albicans agents: an intuition from molecular modelling, pharmacokinetic …

I Benjamin, CU Benson, SA Adalikwu, FA Nduoma… - Chemical Physics …, 2023 - Elsevier
With increasing incidences of antifungal resistance, biofilm formation, and its predilection for
vulnerable populations, Candida albicans have been reported to cause a wide range of …

Molecular simulation of Cu, Ag, and Au-decorated Si-doped graphene quantum dots (Si@ QD) nanostructured as sensors for SO2 trapping

H Louis, K Chukwuemeka, EC Agwamba… - Journal of Molecular …, 2023 - Elsevier
In view of the numerous environmental hazards and health challenges linked to sulfur (iv)
oxide (SO 2), an indirect greenhouse gas, and the resultant need to develop efficient gas …

Investigation of the Anti-Plasmodial Properties of N-2-Oxo Pyrrolidine Pentanamide-Based Sulfonamides: Experimental and Theoretical Approach

FC Asogwa, O C. Ekoh, D I. Ugwu… - Polycyclic Aromatic …, 2024 - Taylor & Francis
The study aimed to investigate novel pyrrolidine-pentanamide derivatives of sulfonamides
as potential anti-malaria agents through a comprehensive approach involving experimental …

Natural Andrographolide Isolated from Andrographis paniculata as Potent Epileptic Agent: Spectroscopy, Molecular Structure, and Molecular Docking Investigation

AE Owen, H Louis, EU Ejiofor, W Emori, TE Gber… - Chemistry Africa, 2023 - Springer
In this study, a comparative experimental and theoretical investigation of the isolation,
characterization, and molecular electronic investigation of natural andrographolide is …

Single-metal (Cu, Ag, Au) encapsulated gallium nitride nanotube (GaNNT) as glucose nonenzymatic nanosensors for monitoring diabetes: Perspective from DFT …

HO Edet, H Louis, UC Godwin, SA Adalikwu… - Journal of Molecular …, 2023 - Elsevier
Developing a diabetes biomarker detector would benefit both current and potential diabetes
patients. Therefore, in this present study, metals (Ag, Au, and Cu) doped gallium nitride …

[HTML][HTML] Metals (Cu, Ag, Au) encapsulated gallium nitride nanotubes (GaNNTs) as sensors for hexabromodiphenyl ether (HBDE) emerging organic pollutant: A …

FO Ogungbemiro, H Louis, I Benjamin, GA Okon… - Journal of Saudi …, 2023 - Elsevier
This study is aimed at investigating the potential of transition metals (Cu, Ag, Au) doped
gallium nitride nanotubes (GaNNTs) as sensor materials for the enhanced detection of …

Systematic exo-endo encapsulation of hydroxyurea (HU) by Cu, Ag, and Au-doped gallium nitride nanotubes (GaNNT) for smart therapeutic delivery

H Louis, EN Mbim, GA Okon, UO Edet… - Computers in Biology …, 2023 - Elsevier
Similar to the more well-known carbon nanotubes, gallium nitride nanotubes (GaNNT) are
among the materials that scientists have found to be extremely helpful in transporting drugs …

Molecular simulation of Cu, Ag, and Au-decorated Molybdenum doped graphene nanoflakes as biosensor for carmustine, an anticancer drug

CM Chima, H Louis, D Charlie, A Imojara… - Materials Science in …, 2023 - Elsevier
This study delves into the fascinating realm of molybdenum-doped graphene (Mo@ GP)
complexes, featuring captivating adsorption sites for oxygen (O) and chlorine (Cl), adorned …

Isolation, vibrational analysis, quantum chemical studies, nature of bonding, and molecular docking studies of triterpenoid isolates from Ganoderma lucidum as potent …

EED Okon, D Oche, IU Bassey, W Emori… - Journal of the Indian …, 2023 - Elsevier
Abstract The bacteria Salmonella Typhi is the source of the dangerous and perhaps fatal
disease known as typhoid fever. Typhoid fever treatment is difficult despite the availability of …

Computational Investigation of the Intermolecular Interactions between Decatungstate Acid and CX2O (X=H, F, Cl, and Br)

M Doust Mohammadi, F Abbas, H Louis, Z Zeb… - …, 2023 - Wiley Online Library
This study explores intermolecular interactions between the polyoxometalate (POM)
compound, decatungstate acid, and CX2O (X= H, F, Cl, and Br). Initial optimizations were …