Results 181 to 190 of about 109,425 (326)

Molecular Docking and Dynamic Simulation Studies of Benzoylated Emodin into HBV Core Protein [PDF]

, 2018
Firdayani Firdayani, Ade Arsianti, Churiyah Churiyah C, Arry Yanuar   +3 more
openalex   +1 more source

Gecko‐Inspired Adhesive for Robotic Grippers with Excellent Ultra‐Low‐Temperature Adhesion Performance

Advanced Science, EarlyView.
Phenyl and vinyl groups are used to modify conventional polydimethylsiloxane (PDMS) to yield poly(methylphenylvinylsiloxane) (PMPVS). PMPVS‐based gecko‐inspired arrays with mushroom tips exhibit superior adhesion strength of 36.7 kPa even at −80 °C, which enhances by 5143% compared to PDMS‐based arrays (0.7 kPa at −70 °C).
Jiabao Feng, Hong Zhu, Yadong Lv, Qi Yang, Guangxian Li, Miqiu Kong, Wei Pu   +6 more
wiley   +1 more source

Anti-HIV-drug and phyto-flavonoid combination against SARS-CoV-2: a molecular docking-simulation base assessment. [PDF]

J Biomol Struct Dyn, 2022
Swain SS, Singh SR, Sahoo A, Hussain T, Pati S.   +4 more
europepmc   +1 more source

Synthesis, Crystal Structure Analysis, Quantum Computation, Molecular Docking, and Molecular Dynamics Simulation Studies on 2‐(2‐phenylazo)‐anilino‐4,6‐di‐ tert ‐butyl‐phenol [PDF]

Pooja Bhardwaj, Akhilesh Kumar, Priyanshu Komal, Ravindra Singh, Himanshu Arora, Saleem Javed, Amit Rajput   +6 more
openalex   +1 more source

Targeting Microglial CD49a Inhibits Neuroinflammation and Demonstrates Therapeutic Potential for Parkinson's Disease

Advanced Science, EarlyView.
This study shows that integrin receptor CD49a (Itga1 gene) is significantly upregulated in hyperactivated microglia and microglia‐specific knockdown of Itga1 rescues neuroinflammation and neurodegeneration in a chronic Parkinson's disease (PD) model by targeting PGAM5‐mediated mitochondrial dysfunction and NLRP3 activation. Targeted inhibition of CD49a
Huanpeng Lu, Yunmin Zhu, Xi Wang, Zelin Wu, Zijian Xu, Rongqing Chen, Yanwu Guo   +6 more
wiley   +1 more source

Dapagliflozin in Chronic Kidney Disease: Insights from Network Pharmacology and Molecular Docking Simulation. [PDF]

Life (Basel)
Phongphithakchai A, Tedasen A, Netphakdee R, Leelawattana R, Srithongkul T, Raksasuk S, Huang JC, Chatatikun M.   +7 more
europepmc   +1 more source

Magnesium Structure‐Function Integration Platform for Spatiotemporal Multi‐Modality Therapy: Combining Hormonotherapy and Immunotherapy in Prostate Cancer

Advanced Science, EarlyView.
The schematic illustration of the MHSCG platform for spatiotemporal responsive GRb1 release to induce androgen deprivation therapy (ADT) and immunogenic cell death (ICD) multimodal therapy in prostate cancer. Abstract Metal‐based immunotherapy represents a promising strategy for enhancing antitumor efficacy; however, its clinical application is limited
Rui Zan, Qianping Mao, Keyi Wang, Guodong Zou, Shi Yang, Hua Qiu, Xiang Fang, Guiqing Wang, Xinyi Zhou, Jiexia Wen, Shuai Jiang, Ran Huang, Qiuming Peng, Tao Suo   +13 more
wiley   +1 more source

Novel Hybrid Heterocycles Based on 1,4-Diphenylpiperazine Moiety: Synthesis via Hantzsch and Biginelli Reactions, Molecular Docking Simulation, and Antimicrobial Activities. [PDF]

ACS Omega
Diab HM, Salem ME, Abdellatif M, Soliman MM, Abdelhamid IA, Elwahy AHM, Raza N, El-Gabry YA.   +7 more
europepmc   +1 more source

Molecular docking simulation reveals ACE2 polymorphisms that may increase the affinity of ACE2 with the SARS-CoV-2 Spike protein. [PDF]

Biochimie, 2021
Calcagnile M, Forgez P, Iannelli A, Bucci C, Alifano M, Alifano P.   +5 more
europepmc   +1 more source

Oxidative functionalization of triterpenes isolated from Euphorbia resinifera latex: Semisynthesis, ADME-Tox, molecular docking, and molecular dynamics simulations

, 2023
Imane Yamari, Ayoub Mouhib, Bouchra Es‐Sounni, Rida Nejjari, Noureddine Mazoir, Mohamed Bakhouch, Abdelkrim Mouzdahir, Ahmed Benharref, Mhammed El Kouali, Samir Chtita   +9 more
openalex   +1 more source