The role of NQO1 in ovarian cancer
Ovarian cancer is one of the most dangerous gynecologic malignancies showing a high
fatality rate because of late diagnosis and relapse occurrence due to chemoresistance …
fatality rate because of late diagnosis and relapse occurrence due to chemoresistance …
Synthesis, characterization, pharmacological screening, molecular docking, DFT, MESP, ADMET studies of transition metal (II) chelates of bidentate schiff base ligand
The death causing infectious diseases are increased very rapidly, therefore, to find out a
significant agent for these ailments, a family of four transition metal complexes were …
significant agent for these ailments, a family of four transition metal complexes were …
The power of molecular dynamics simulations and their applications to discover cysteine protease inhibitors
IJ dos Santos Nascimento… - Mini Reviews in …, 2024 - benthamdirect.com
A large family of enzymes with the function of hydrolyzing peptide bonds, called peptidases
or cysteine proteases (CPs), are divided into three categories according to the peptide chain …
or cysteine proteases (CPs), are divided into three categories according to the peptide chain …
[PDF][PDF] Investigation of the new inhibitors by modified derivatives of pinocembrin for the treatment of monkeypox and marburg virus with different computational …
The widespread occurrence of Monkeypox and Marburg virus fatalities all over the globe
has prompted biologists, pharmacologists, chemists, and pharmacists to develop potent …
has prompted biologists, pharmacologists, chemists, and pharmacists to develop potent …
Exploration of morpholine-thiophene hybrid thiosemicarbazones for the treatment of ureolytic bacterial infections via targeting urease enzyme: Synthesis, biochemical …
An important component of the pathogenicity of potentially pathogenic bacteria in humans is
the urease enzyme. In order to avoid the detrimental impact of ureolytic bacterial infections …
the urease enzyme. In order to avoid the detrimental impact of ureolytic bacterial infections …
[HTML][HTML] Synthesis, characterization, biological activity, and modelling protein docking of divalent, trivalent, and tetravalent metal ion complexes of new azo dye ligand …
Abstract The ligand 2-[2′-(benzimidazole) azo]-4, 6-dimethyl benzoic acid (BADMB) was
employed to create coordination complexes with Pd (II), Co (III), and Pt (IV) ions. A variety of …
employed to create coordination complexes with Pd (II), Co (III), and Pt (IV) ions. A variety of …
Experimental and theoretical quantum chemical studies of 2-(2-acetamidophenyl)-2-oxo-N-(pyridin-2-ylmethyl)acetamide and its copper(II) complex: molecular …
Abstract Newly synthesized ligand 2-(2-acetamidophenyl)-2-oxo-N-(pyridin-2-ylmethyl)
acetamide and its copper (II) complex were characterized by elemental analyses, FT-IR, UV …
acetamide and its copper (II) complex were characterized by elemental analyses, FT-IR, UV …
Overview on Building Blocks and Applications of Efficient and Robust Extended Tight Binding
A Katbashev, M Stahn, T Rose, V Alizadeh, M Friede… - 2024 - chemrxiv.org
The extended tight binding (xTB) family of methods opened many new possibilities in the
field of computational chemistry. Within just five years, the GFN2-xTB parametrization for all …
field of computational chemistry. Within just five years, the GFN2-xTB parametrization for all …
Exploring Antimalarial and Cytotoxic Activities of Hibiscus cannabinus and Corchorus capsularis Extracts Through In‐Vitro and In‐Silico Approaches
Malaria is an infectious disease, endemic to tropical and sub‐tropical regions causing half a
million people's deaths every year. Bioactive compounds derived from medicinal plants are …
million people's deaths every year. Bioactive compounds derived from medicinal plants are …
In vitro and In silico Studies of Kayu Raja (Cassia fistula L.) Leaves Extract as Potential Antifungal Agent Against Candida albicans
TD Christian, K Kasiyati, T Yuliani, A Saputri… - Jurnal Kimia Sains … - ejournal.undip.ac.id
Candida albicans is one of the most common fungal species causing opportunistic
infections, such as candidiasis. Candida albicans has the ability to produce and secrete …
infections, such as candidiasis. Candida albicans has the ability to produce and secrete …