Results 91 to 100 of about 77,593 (305)

Molecular Docking Simulation to Predict Inhibitors Against Zinc Transporters

Zinc is one of the essential elements required by our body for normal functioning. This zinc concentration inside the cell is maintained by a particular type of protein called zinc transporter (ZnT).
Gaurav, Sharma, Irene, Batta
core   +1 more source

Sex‐Specific Regulation of Glycemic Homeostasis by Theabrownin from Pu‐erh Tea

Advanced Science, EarlyView.
Pu‐erh tea's key component, theabrownin (TB), lowers blood glucose in a sex‐specific manner. In females, estrogen boosts intestinal MUC2 production, which dramatically enhances TB's ability to inhibit the carbohydrate‐digesting enzyme α‐glucosidase.
Yang Li, Junliang Kuang, Dan Zheng, Jieyi Wang, Kun Ge, Chun Qu, Xiaojiao Zheng, Zhenxing Ren, Fengjie Huang, Mingliang Zhao, Yimin Sun, Huiheng Zhang, Keke Ding, Xixi Xia, Yajun Tang, Lu Liu, Jian Zhou, Fei Gao, Xiaohui Ma, Yongquan Xu, Guoxiang Xie, Aihua Zhao, Wei Jia   +22 more
wiley   +1 more source

Computational Analyses of Protein-Ligand Interactions [PDF]

, 2010
Protein-ligand interactions have a central role in all processes in living systems. A comprehensive understanding of protein interactions with small molecules is of great interest as it provides opportunities for understanding protein function and ...
Haider, Kamran
core  

Protein-Protein Docking with F2Dock 2.0 and GB-Rerank

, 2013
Rezaul Chowdhury is with UT Austin; Muhibur Rasheed is with UT Austin; Maysam Moussalem is with UT Austin; Donald Keidel is with The Scripps Research Institute; Arthur Olson is with The Scripps Research Institute; Michel Sanner is with The Scripps ...
Maysam Moussalem, Donald Keidel, Chowdhury Rezaul, Olson Arthur, Michel Sanner, Keidel, Donald, Rezaul Chowdhury (385928), Donald Keidel (385930), Muhibur Rasheed (385929), Bajaj Chandrajit, Chowdhury, Rezaul, Michel Sanner (385933), Sanner, Michel, Moussalem, Maysam, Rezaul Chowdhury, Arthur Olson, Rasheed Muhibur, Sanner Michel, Muhibur Rasheed, Bajaj, Chandrajit, Chandrajit Bajaj, Maysam Moussalem (385931), Keidel Donald, Rasheed, Muhibur, Arthur Olson (385932), Olson, Arthur, Chandrajit Bajaj (61229), Moussalem Maysam   +27 more
core   +1 more source

NUP85 Mediates Endoplasmic Reticulum Stress through the USP47/ASK1 Signaling Pathway to Regulate the Progression of Liver Fibrosis

Advanced Science, EarlyView.
In the present study, we have demonstrated that the NUP85‐USP47‐ASK1 signaling pathway may have regulated the progression of liver fibrosis through modulating ERS. Additionally, we have developed a CREKA‐coupled liposome to target delivery of MV, a pharmacological inhibitor of NUP85, to activated HSCs, thereby attenuating liver fibrosis. ABSTRACT Liver
Dashuai Yang, Haoran Yang, Linxin Pan, Chang Tian, Fucheng Zuo, Shilei Huang, Xianrui Li, Ming Chen, Cheng Qian, Jie Wang, Zhaolin Chen, Tao Xu   +11 more
wiley   +1 more source

molecular docking

Molecular docking is a computational simulation technique used to predict the optimal binding orientation and affinity between a ligand and its macromolecular target, such as an enzyme, receptor, or nucleic acid. It represents one of the most fundamental
Atika suri, Tabitha Oschika Putri, Ananta Nazira Meliano, Indah Handini Putri, Ihya Zakira Sani, Iffat Syafiqoh Afif, Rahadian Zainul   +6 more
core   +3 more sources

Effects of Curcumin on Radiation/Chemotherapy-Induced Oral Mucositis: Combined Meta-Analysis, Network Pharmacology, Molecular Docking, and Molecular Dynamics Simulation

Current Issues in Molecular Biology
The study aims to investigate the effects of curcumin on radiation/chemotherapy-induced oral mucositis (R/CIOM) and preliminarily explore its mechanism.
Zhi-Xing Chen, Ya-Shi Qin, Bang-Hui Shi, Bi-Yun Gao, Ren-Chuan Tao, Xiang-Zhi Yong   +5 more
doaj   +1 more source

Molecular Dynamics Analysis of Potent inhibitors of M2 Proton Channel against H1N1 Swine Influenza Virus

, 2012
[[abstract]]The recent H1N1 (swine) influenza pandemic highlighted the urgent need of having effective anti‐viral strategies. In addition to neuraminidase inhibitors, there is another class of anti-viral drug known as M2 inhibitors that were, in the past,
蔡輔仁;Tsai, Fuu-Jen;陳語謙;Chen, Calvin Yu-Chian
core  

Results of initial molecular docking simulation.

, 2014
(A) Validation of molecular docking simulation by comparison between crystal structure (gray) of S. cerevisiae isomaltase (PDB ID: 3A4A) co-crystallized with the α-D-glucose and homology modeled structure (blue) of the isomaltase with its docking pose ...
Songmi Kim (131671), Ki Hun Park (511972), Mahreen Arooj (286338), Siu Kim (511971), Byeong-Woo Kim (140529), Keun Woo Lee (117280), Yuno Lee (117275), Swan Hwang (131678), Jun Young Kim (511970)   +8 more
core   +1 more source

A Microbial Lipid‐ATP Synthase Axis Fuels NK Cell Antitumor Activity

Advanced Science, EarlyView.
This study focuses on the mechanism by which gut microbiota‐derived outer membrane vesicles (OMVs) regulate NK cell antitumor activity. B. intestinalis is identified to decrease extra‐intestinal tumor growth via its OMVs enriched in sphingosine (SP).
Kaiyuan Yu, Xinyu Sun, Wanxia Ma, Jianming Yang, Xuan Sun, Lisong Zhang, Yumeng Liu, Tianshu Ren, Qi Wang, Jingyu Wang, Xiao Li, Xianping Peng, Liu Yang, Junqiang Lv, Zhi Yao, Zhi‐Song Zhang, Quan Wang   +16 more
wiley   +1 more source