Fluorescence spectrophotometry for COVID-19 determination in clinical swab samples [0.03%]
临床拭子样本COVID-19检测的荧光分光光度法
Kartika A Madurani,Suprapto,Muhammad Yudha Syahputra et al.
Kartika A Madurani et al.
Considering the limitations of the assays currently available for the detection of severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) and its emerging variants, a simple and rapid method using fluorescence spectrophotometry was de...
Prediction of COVID-19 manipulation by selective ACE inhibitory compounds of Potentilla reptant root: In silico study and ADMET profile [0.03%]
基于牛膝根中选择性ACE抑制化合物的COVID-19治疗作用预测：离体研究与ADMET性质分析
Yuan Xu,Mahmood Al-Mualm,Ermias Mergia Terefe et al.
Yuan Xu et al.
In the novel SARS-CoV-2 (COVID-19) as a global emergency event, the main reason of the cardiac injury from COVID-19 is angiotensin-converting enzyme 2 (ACE2) targeting in SARS-CoV-2 infection. The inhibition of ACE2 induces an increase in t...
Amomum tsao-ko essential oil, a novel anti-COVID-19 Omicron spike protein natural products: A computational study [0.03%]
一种新的抗COVID-19奥密克戎刺突蛋白天然产物——卡瓦壳果实时油：一项计算研究
Ju-Zhao Liu,Hong-Chang Lyu,Yu-Jie Fu et al.
Ju-Zhao Liu et al.
Since the outbreak of COVID-19, this virus has been constantly mutating. The latest mutant Omicron has been identified as VOC by WHO. The main reason for its concern is the mutation of 46 amino acids in spike protein, which has brought the ...
Sustainable adsorptive removal of antibiotic residues by chitosan composites: An insight into current developments and future recommendations [0.03%]
壳聚糖复合材料吸附去除抗生素残留的可持续性研究：当前进展与未来展望的新视野
Eman M Abd El-Monaem,Abdelazeem S Eltaweil,Hala M Elshishini et al.
Eman M Abd El-Monaem et al.
During COVID-19 crisis, water pollution caused by pharmaceutical residuals have enormously aggravated since millions of patients worldwide are consuming tons of drugs daily. Antibiotics are the preponderance pharmaceutical pollutants in wat...
Computational screening and biochemical analysis of Pistacia integerrima and Pandanus odorifer plants to find effective inhibitors against Receptor-Binding domain (RBD) of the spike protein of SARS-Cov-2 [0.03%]
计算筛选和生物化学分析刺柏和密香以寻找针对SARS-CoV-2刺突蛋白受体结合域（RBD）的有效抑制剂
Gobindo Kumar Paul,Shafi Mahmud,Afaf A Aldahish et al.
Gobindo Kumar Paul et al.
Although World Health Organization-approved emergency vaccines are available in many countries, the mortality rate from COVID-19 remains high due to the fourth or fifth wave and the delta variant of the coronavirus. Thus, an effective mecha...
A possible potential COVID-19 drug candidate: Diethyl 2-(2-(2-(3-methyl-2-oxoquinoxalin-1(2H)-yl)acetyl)hydrazono)malonate: Docking of disordered independent molecules of a novel crystal structure, HSA/DFT/XRD and cytotoxicity [0.03%]
潜在的COVID-19药物候选物：双乙基2-(2-(2-(3-甲基-2-氧代喹喔啉-1(2H)-基)乙酰基)肼基)琥珀酸酯：新型晶体结构无序独立分子对接、HSA/DFT/XRD及细胞毒性
Mohcine Missioui,Musa A Said,Güneş Demirtaş et al.
Mohcine Missioui et al.
This study reports the synthesis, characterization and importance of a novel diethyl 2-(2-(2-(3-methyl-2-oxoquinoxalin-1(2H)-yl)acetyl)hydrazono)malonate (MQOAHM). Two independent molecular structures of the disordered MQOAHM have been esta...
QSAR based virtual screening derived identification of a novel hit as a SARS CoV-229E 3CLpro Inhibitor: GA-MLR QSAR modeling supported by molecular Docking, molecular dynamics simulation and MMGBSA calculation approaches [0.03%]
基于QSAR的虚拟筛选鉴定SARS CoV-2 29E 3CL pro抑制剂：通过分子对接、分子动力学模拟和MMGBSA计算方法支持的GA-MLR QSAR建模
R D Jawarkar,Ravindrakumar L Bakal,Magdi E A Zaki et al.
R D Jawarkar et al.
Congruous coronavirus drug targets and analogous lead molecules must be identified as quickly as possible to produce antiviral therapeutics against human coronavirus (HCoV SARS 3CLpro) infections. In the present communication, we bear recog...
In silico screening, SAR and kinetic studies of naturally occurring flavonoids against SARS CoV-2 main protease [0.03%]
计算筛选、活性趋势研究及天然黄酮类化合物针对SARS冠状病毒主要蛋白酶的动力学研究
Muhammad Imran,Sana Iqbal,Ajaz Hussain et al.
Muhammad Imran et al.
The Severe Acute Respiratory Syndrome Coronavirus (SARS-CoV-2) pandemic has become a global challenge based on its replication within the host cells that relies on non-structural proteins, protease (Mpro). Flavonoids, an important class of ...
Antiviral peptides against the main protease of SARS-CoV-2: A molecular docking and dynamics study [0.03%]
针对SARS-CoV-2主要蛋白酶的抗病毒肽研究：分子对接及动力学模拟
Shafi Mahmud,Suvro Biswas,Gobindo Kumar Paul et al.
Shafi Mahmud et al.
The recent coronavirus outbreak has changed the world's economy and health sectors due to the high mortality and transmission rates. Because the development of new effective vaccines or treatments against the virus can take time, an urgent ...
Structure- and Ligand-Based in silico Studies towards the Repurposing of Marine Bioactive Compounds to Target SARS-CoV-2 [0.03%]
基于结构和配体的计算研究，重新定位海洋生物活性化合物以靶向SARS-CoV-2
Marwa A A Fayed,Mohammed Farrag El-Behairy,Inas A Abdallah et al.
Marwa A A Fayed et al.
This work was a structured virtual screening for marine bioactive compounds with reported antiviral activities which were subjected to structure-based studies against SARS-CoV-2 co-crystallized proteins. The molecular docking of marine bioa...