Results 21 to 30 of about 697,276 (400)

Facebook Brand Communities and Social Capital [PDF]

Athens Journal of Mass Media and Communications, 2017
This study examines the role of social media-based marketing in generating social capital by analyzing wall posts and comments on Facebook pages of a for-profit social enterprise (TOMS) and a conventional for-profit company (Sperry Top-Sider).
Hyunjin Seo, Ren-Whei Harn , Salman Husain   +2 more
doaj   +1 more source

Molecular docking as a tool for the discovery of molecular targets of nutraceuticals in diseases management

Scientific Reports, 2023
Molecular docking is a computational technique that predicts the binding affinity of ligands to receptor proteins. Although it has potential uses in nutraceutical research, it has developed into a formidable tool for drug development.
P. Agu, C. Afiukwa, O. U. Orji, E. Ezeh, I. H. Ofoke, C. Ogbu, E. Ugwuja, P. M. Aja   +7 more
semanticscholar   +1 more source

GNINA 1.0: molecular docking with deep learning

Journal of Cheminformatics, 2021
Molecular docking computationally predicts the conformation of a small molecule when binding to a receptor. Scoring functions are a vital piece of any molecular docking pipeline as they determine the fitness of sampled poses.
Andrew T. McNutt, Paul G. Francoeur, Rishal Aggarwal, Tomohide Masuda, Rocco Meli, Matthew Ragoza, Jocelyn Sunseri, D. Koes   +7 more
semanticscholar   +1 more source

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

Christian 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

Docking and Undocking a Modular Underactuated Oscillating Swimming Robot [PDF]

, 2021
We describe a docking mechanism and strategy to allow modular self-assembly for the Modboat: an inexpensive underactuated oscillating swimming robot powered by a single motor. Because propulsion is achieved through oscillation, orientation can be controlled only in the average; this complicates docking, which requires precise position and orientation ...
arxiv   +1 more source

AutoDock Vina: Improving the speed and accuracy of docking with a new scoring function, efficient optimization, and multithreading

Journal of Computational Chemistry, 2009
AutoDock Vina, a new program for molecular docking and virtual screening, is presented. AutoDock Vina achieves an approximately two orders of magnitude speed‐up compared with the molecular docking software previously developed in our lab (AutoDock 4 ...
Oleg Trott, A. Olson
semanticscholar   +1 more source

Integration of Molecular Docking Analysis and Molecular Dynamics Simulations for Studying Food Proteins and Bioactive Peptides.

Journal of Agricultural and Food Chemistry, 2022
In silico tools, such as molecular docking, are widely applied to study interactions and binding affinity of biological activity of proteins and peptides.
A. Vidal-Limon, J. E. Aguilar-Toalá, A. Liceaga   +2 more
semanticscholar   +1 more source

Molecular interaction analysis and visualization of protein-ligand docking using Biovia Discovery Studio Visualizer

Indonesian Journal of Computational Biology (IJCB), 2023
Molecular docking interpretation is one of the crucial part before determining the result. Docking is commonly used to study the biomolecular interaction, usually for protein-ligand interaction, and to study about the molecular mechanism.
Umi Baroroh, S.Si., M.Biotek., Zahra Silmi Muscifa, Wanda Destiarani, Fauzian Giansyah Rohmatullah, Muhammad Yusuf   +4 more
semanticscholar   +1 more source

Larvicidal Activities of 2-Aryl-2,3-Dihydroquinazolin -4-ones against Malaria Vector Anopheles arabiensis, In Silico ADMET Prediction and Molecular Target Investigation

Molecules, 2020
Malaria, affecting all continents, remains one of the life-threatening diseases introduced by parasites that are transmitted to humans through the bites of infected Anopheles mosquitoes.
Katharigatta N. Venugopala, Pushpalatha Ramachandra, Christophe Tratrat, Raquel M. Gleiser, Subhrajyoti Bhandary, Deepak Chopra, Mohamed A. Morsy, Bandar E. Aldhubiab, Mahesh Attimarad, Anroop B. Nair, Nagaraja Sreeharsha, Rashmi Venugopala, Pran Kishore Deb, Sandeep Chandrashekharappa, Hany Ezzat Khalil, Osama I. Alwassil, Sara Nidal Abed, Yazan A. Bataineh, Ramachandra Palenge, Michelyne Haroun, Shinu Pottathil, Meravanige B. Girish, Sabah H. Akrawi, Viresh Mohanlall   +23 more
doaj   +1 more source

Synthesis of some quinazolinones inspired from the natural alkaloid L-norephedrine as EGFR inhibitors and radiosensitizers

Journal of Enzyme Inhibition and Medicinal Chemistry, 2021
A set of quinazolinones synthesized by the aid of L-norephedrine was assembled to generate novel analogues as potential anticancer and radiosensitizing agents.
Mostafa M. Ghorab, Maged S. Abdel-Kader, Ali S. Alqahtani, Aiten M. Soliman   +3 more
doaj   +1 more source