Results 121 to 130 of about 4,190,416 (396)
The Saccharomyces cerevisiae amino acid transporter Lyp1 has a broad substrate spectrum
FEBS Letters, EarlyView.In Saccharomyces cerevisiae, Yeast Amino acid Transporter family members mediate the import of amino acids, ranging from substrate specialists to generalists. Here, we show that the specialist transporter, Lyp1, has a broader substrate spectrum than previously described, with affinity constants spanning from micromolar to millimolar.
Foteini Karapanagioti +3 more
wiley +1 more source
Molecular docking via quantum approximate optimization algorithm [PDF]
Phys. Rev. Applied 21, 034036 (2024), 2023 Molecular docking plays a pivotal role in drug discovery and precision medicine, enabling us to understand protein functions and advance novel therapeutics. Here, we introduce a potential alternative solution to this problem, the digitized-counterdiabatic quantum approximate optimization algorithm (DC-QAOA), which utilizes counterdiabatic driving and ...
arxiv
The benefits of in silico modeling to identify possible small-molecule drugs and their off-target interactions [PDF]
, 2019 Accepted for publication in a future issue of Future Medicinal Chemistry.The research into the use of small molecules as drugs continues to be a key driver in the development of molecular databases, computer-aided drug design software and collaborative ...
Blomberg N +6 more
core +1 more source
Drug Development and Industrial Pharmacy, 2020 Purpose Huashi Baidu formula (HSBDF) was developed to treat the patients with severe COVID-19 in China. The purpose of this study was to explore its active compounds and demonstrate its mechanisms against severe acute respiratory syndrome coronavirus 2 ...
Qu Tao +7 more
semanticscholar +1 more source
Suitable Docking Protocol for the Design of Novel Coumarin Derivatives with Selective MAO-B Effects
Journal of Molecular Docking, 2021 Recently, the application of molecular docking is drastically increasing due to the rapid growth of resolved crystallographic receptors with co-crystallized ligands. However, the inability of docking softwares to correctly score the occurred interactions
Emilio Viktorov Mateev +3 more
doaj +1 more source
FEBS Letters, EarlyView.In lymphoid organs, antigen recognition and B cell receptor signaling rely on integrins and the cytoskeleton. Integrins act as mechanoreceptors, couple B cell receptor activation to cytoskeletal remodeling, and support immune synapse formation as well as antigen extraction.
Abhishek Pethe, Tanja Nicole Hartmann
wiley +1 more source
Kajian Pendekatan Penempatan Ligan Pada Protein Menggunakan Algoritma Genetika [PDF]
, 2017 Penempatan ligan pada protein atau molecule docking merupakan bidang komputasi yang sedang berkembang. Metode molecular docking adalah metode yang bermanfaat untuk mencari kombinasi interaksi protein dan ligan serta menjadi dasar penemuan obat secara ...
Irawan, Mohammad Isa, Setiawan, Hartanto
core +2 more sources
, 2020 To Editor in Chief Chemarxiv Respected Sir/Madam Subject: submission of preprint of an article to ChemRxiv on molecular docking studies of arginine and its structural analogues on COV-19 for publication.
P. Habibzadeh, E. Stoneman
semanticscholar +1 more source
BioMed Research International, 2021 Background Yinchen Wuling powder is often used to treat clinical hyperlipidemia, although its mechanism of action remains unclear. In this study, we aimed to investigate the active ingredients found in Yinchen Wuling powder and find its mechanism of ...
Jiahao Ye, Lin Li, Zhixi Hu
semanticscholar +1 more source
Journal of Molecular Docking, 2022 Lymphatic filariasis and onchocerciasis are two common filarial diseases caused by a group of parasitic nematodes called filarial worms, which co-habit with the bacteria organism Wolbachia.
Fabian Audu Ugbe +3 more
doaj +1 more source