Results 11 to 20 of about 231,170 (243)

Molecular Docking Investigation, Pharmacokinetic Analysis, and Molecular Dynamic Simulation of Some Benzoxaborole-Benzimidazole Hybrids: An Approach to Identifying Superior Onchocerca Inhibitors

open access: yesBorneo Journal of Pharmacy, 2023
Onchocerciasis is one of the major neglected tropical diseases caused by the filarial worm (Onchocerca volvulus), affecting an estimated population of about 37 million people living predominantly in tropical Africa.
Fabian Audu Ugbe   +3 more
doaj   +1 more source

ELECTRON WITHDRAWING GROUP EFFECT ON BIOLOGICAL ACTIVITIES OF PYRIMIDINE HYBRIDS AS POTENTIAL ANTI-MATRIX METALLOPROTEINASE-7 [PDF]

open access: yesQuímica Nova, 2023
We investigated the effect of both electron donating group and e//lectron withdrawing group on biological activity of pyrimidine-based compounds as metalloproteinase-7 inhibitors and predicting a library of drug-like compounds with potent cytotoxicity ...
Abel Kolawole Oyebamiji   +7 more
doaj   +1 more source

Risk assessment of honey bee stressors based on in silico analysis of molecular interactions

open access: yesEFSA Journal, 2022
A global decline of the honey bee Apis mellifera has been observed in the last decades. This pollinator plays a fundamental role in food production and the economy in Europe.
Mónica delÁguila Conde   +1 more
doaj   +1 more source

Increasing the church’s relevance and impact in poor-resource areas by adding sexual reproductive health to missional activities

open access: yesChristian Journal for Global Health, 2017
Life saving midwifery knowledge must reach the key influential stakeholders in developing countries if the maternal death rate is to be reduced. The church holds the influence and has the networks and training institutions that can be fully expanded to ...
Margaret Lynne Docking
doaj   +1 more source

Cell-Dock: high-performance protein–protein docking [PDF]

open access: yesBioinformatics, 2012
Abstract Summary: The application of docking to large-scale experiments or the explicit treatment of protein flexibility are part of the new challenges in structural bioinformatics that will require large computer resources and more efficient algorithms. Highly optimized fast Fourier transform (FFT) approaches are broadly used in docking
Carles, Pons   +6 more
openaire   +2 more sources

Some Chemical Properties and Biological Activity of an Endemic Plant Tripleurospermum callosum as a Case Study [PDF]

open access: yesIranian Journal of Chemistry & Chemical Engineering, 2022
T. callosum an endemic plant, used in this study, efficiently inhibited enzymes, with IC50 values of 28.87 mg/mL, 15.75 mg/mL, 36.47 mg/mL, and 60.0 mg/mL, for AChE, BChE, α-Gly, and GST respectively.
Abdulmelik Aras
doaj   +1 more source

Synthesis and Characterization of Novel Copper(II)-Sunitinib Complex: Molecular Docking, DFT Studies, Hirshfeld Analysis and Cytotoxicity Studies

open access: yesInorganics, 2021
The main goal of this work was to report the synthesis, characterization, and cytotoxicity study of a novel copper(II)-sunitinib complex, CuSun. It has been synthesized and characterized in solid state and in solution by different methods (such as DFT ...
Facundo Tarasi   +8 more
doaj   +1 more source

Structural Analysis and Mutational Assessment of the Photosystem II Chlorophyll-Binding Protein (CP47) in the Cyanobacterium Synechocystis sp. PCC 6803: Modeling and Simulation Study [PDF]

open access: yesIranian Journal of Chemistry & Chemical Engineering, 2023
CP47 is one of the essential components of photosystem II (PSII) in green plants, green algae, and cyanobacteria; which is involved in the light reactions of photosynthesis.
Mehr Ali Mahmood Janlou   +3 more
doaj   +1 more source

Potential of Epidermal Growth Factor-like Peptide from the Sea Cucumber Stichopus horrens to Increase the Growth of Human Cells: In Silico Molecular Docking Approach

open access: yesMarine Drugs, 2022
The sea cucumber is prominent as a traditional remedy among Asians for wound healing due to its high capacity for regeneration after expulsion of its internal organs.
Nur Shazwani Mohd Pilus   +3 more
doaj   +1 more source

Research on the Motion and Dynamic Characteristics of the Hose-and-Drogue System under Bow Wave

open access: yesAerospace, 2023
To study the hose-and-drogue system’s motion under bow waves, this paper established a dynamic model of the hose-and-drogue system based on the multibody dynamics theory and the rigid ball-and-rod model.
Chunjie Zheng   +3 more
doaj   +1 more source

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