Chitosan-Based Formulations Intended as Protective Spray for Mask Surfaces in Prevention of Coronavirus Dissemination [0.03%]
用于预防冠状病毒传播的口罩表面保护喷雾的壳聚糖制剂
Victoria Belen Ayala-Peña,María Julia Martin,Florencia Favatela et al.
Victoria Belen Ayala-Peña et al.
The extraordinary occurrence of COVID-19 by the fast expansion of viral infections has propelled particular interest in developing novel antiviral and virucidal agents to guarantee personal security. The main objective of this work is to pr...
Contrasting the Noncovalent Interactions of Aromatic Sulfonyl Fluoride and Sulfonyl Chloride Motifs via Crystallography and Hirshfeld Surfaces [0.03%]
通过晶体学和Hirshfeld表面对比芳香磺酰氟和磺酰氯基团的非共价相互作用
Sophia Bellia,Lara I Teodoro,Antonio J Barbosa et al.
Sophia Bellia et al.
A heteroaryl sulfonyl(VI) fluoride, 4-chloro-7-fluorosulfonyl-2,1,3-benzoxadiazole, was synthesized from its chloride counterpart (4-chloro-7-chlorosulfonyl-2,1,3-benzoxadiazole) and the X-ray structure analysis of these compounds and the i...
Designing of Thiazolidinones for COVID-19 and its Allied Diseases: An In silico Evaluation [0.03%]
针对COVID-19及其相关疾病的噻唑烷酮类药物的设计与分子模拟评价
Muhammad Asam Raza,Umme Farwa,Nida Qurat Ul Ain et al.
Muhammad Asam Raza et al.
In silico studies in terms of density functional theory (DFT), molecular docking, and ADMET (absorption, distribution, metabolism, excretion and toxicity) were performed for 55 thiazolidinones compounds derived from different amines and ald...
Structural and Molecular Packing study of Three New Amidophosphoric Acid Esters and Assessment of Their Inhibiting Activity Against SARS-CoV-2 by Molecular Docking [0.03%]
三种新型酰胺磷酸酯的结构和分子堆积研究及通过分子对接评估其抑制SARS-CoV-2活性
Nafiseh Heidari,Atekeh Tarahhomi,Arie van der Lee
Nafiseh Heidari
Three new compounds of amidophosphoric acid esters with a [OCH2C(CH3)2CH2O]P(O)[X] segment (where X=cyclopentylamido (1), 2-aminopyridinyl (2) and pyrrolidinyl (3)) were synthesized and studied using FT-IR and 31P/13C/1H NMR spectroscopies ...
Synthesis and Biological Evaluation of Umifenovir Analogues as Anti-SARS-CoV-2 Agents [0.03%]
umifenovir衍生物的合成及体外抗新冠病毒活性评价
Hiroaki Tanaka,Seiya Miyagi,Yusuke Yoshida et al.
Hiroaki Tanaka et al.
The unprecedented novel coronavirus disease 2019 (COVID-19) pandemic is a threat to global health and the economy. Since the outbreak of COVID-19, great effort has been made to reposition existing drugs to shorten development timelines, in ...
Bis(thio)carbohydrazone Luminogens with AIEE and ACQ Features and Their In Silico Investigations with SARS-CoV-2 [0.03%]
具有AIEE和ACQ特性的双（硫代）卡波肼光致发光材料及其与SARS-CoV-2的计算机模拟研究
K K Mohammed Hashim,E Manoj,M R Prathapachandra Kurup
K K Mohammed Hashim
Herein, we report two novel multidentate luminogen proligands bis(3,5-diiodosalicylidene) carbohydrazone (H4L1) and bis(3,5-diiodosalicylidene) thiocarbohydrazone (H4L2), which are suitable candidates for biomedical applications. Though the...
In-silico Computational Investigations of AntiViral Lignan Derivatives as Potent Inhibitors of SARS CoV-2 [0.03%]
几种潜在的抑制SARS-CoV-2的茋类 lignan 衍生物的计算研究
Dipen K Sureja,Ashish P Shah,Normi D Gajjar et al.
Dipen K Sureja et al.
Due to alarming outbreak of pandemic COVID-19 in recent times, there is a strong need to discover and identify new antiviral agents acting against SARS CoV-2. Among natural products, lignan derivatives have been found effective against seve...
An Electrochemical Biosensing Platform for the SARS-CoV-2 Spike Antibody Detection Based on the Functionalised SARS-CoV-2 Spike Antigen Modified Electrode [0.03%]
一种基于功能性SARS-CoV-2刺突抗原修饰电极的SARS-CoV-2刺突抗体检测的电化学生物传感平台
Lokman Liv,Hilal Kayabay
Lokman Liv
We developed an electrochemical biosensing platform using gold-clusters, cysteamine, the spike protein of the severe acute respiratory syndrome-coronavirus-2 (SARS-CoV-2) antigen and bovine serum albumin on a glassy carbon electrode able to...
Identification of a Potential mRNA-based Vaccine Candidate against the SARS-CoV-2 Spike Glycoprotein: A Reverse Vaccinology Approach [0.03%]
针对SARS-CoV-2刺突糖蛋白的潜在mRNA疫苗候选物鉴定：反向 vaccinology方法
Olanrewaju Ayodeji Durojaye,Divine Mensah Sedzro,Mukhtar Oluwaseun Idris et al.
Olanrewaju Ayodeji Durojaye et al.
The emergence of the novel coronavirus (SARS-CoV-2) in December 2019 has generated a devastating global consequence which makes the development of a rapidly deployable, effective and safe vaccine candidate an imminent global health priority...
Design, Synthesis, and Development of 4-[(7-Chloroquinoline-4-yl)amino]phenol as a Potential SARS-CoV-2 Mpro Inhibitor [0.03%]
设计、合成和发展4-[(7-氯喹啉-4-基)氨基]苯酚作为SARS-CoV-2 Mpro抑制剂的潜在候选物
James Guevara-Pulido,Ronald A Jiménez,Sandra J Morantes et al.
James Guevara-Pulido et al.
A series of chloroquine analogs were designed to search for a less toxic chloroquine derivative as a potential SARS-CoV-2 Mpro inhibitor. Herein, an ANN-based QSAR model was built to predict the IC50 values of each analog using the experime...