Synthesis of new Spiropyrazole derivatives under microwaves irradiation and docking study for inhibition the microbes and COVID-19Research article Published on 2022-12-012022-10-05 Journal: Journal of Molecular Structure [Category] [DOI] 10.1016/j.molstruc.2022.133581 [Article Type] Research article
Identification of doxorubicin as a potential therapeutic against SARS-CoV-2 (COVID-19) protease: a molecular docking and dynamics simulation studiesArticle Published on 2022-10-012022-11-16 Journal: Journal of biomolecular structure & dynamics [Category] [DOI] 10.1080/07391102.2021.1905551 PMC 바로가기
Antiviral COVID-19 protein and molecular docking: In silico characterization of various antiviral compounds extracted from Arisaema jacquemontii BlumeArticle Published on 2022-09-232022-11-15 Journal: Frontiers in Public Health [Category] [DOI] 10.3389/fpubh.2022.964741 PMC 바로가기
Synthesis, antimicrobial, molecular docking and molecular dynamics studies of lauroyl thymidine analogs against SARS-CoV-2: POM study and identification of the pharmacophore sitesSARS-CoV-2에 대한 라우로일 티미딘 유사체의 합성, 항균, 분자 도킹 및 분자 역학 연구: POM 연구 및 약전 부위 식별Article Published on 2022-08-012022-09-11 Journal: Bioorganic chemistry [Category] [DOI] 10.1016/j.bioorg.2022.105850 PMC 바로가기 [Article Type] Article
Drug repurposing for COVID-19 using computational screening: Is Fostamatinib/R406 a potential candidate?계산 스크리닝을 사용한 COVID-19에 대한 약물 용도 : Fostamatinib/R406은 잠재적 후보입니까?Article Published on 2022-07-012022-08-31 Journal: Methods (San Diego, Calif.) [Category] [DOI] 10.1016/j.ymeth.2021.08.007 PMC 바로가기 [Article Type] Article
Novel Galactopyranoside Esters: Synthesis, Mechanism, In Vitro Antimicrobial Evaluation and Molecular Docking Studies새로운 갈락토피라노사이드 에스테르: 합성, 메커니즘, 시험관 내 항균성 평가 및 분자 도킹 연구Article Published on 2022-06-272022-09-12 Journal: Molecules [Category] [DOI] 10.3390/molecules27134125 PMC 바로가기 [Article Type] Article
Multi-Step In Silico Discovery of Natural Drugs against COVID-19 Targeting Main Protease주요 프로테아제를 표적으로 하는 COVID-19에 대한 천연 약물의 다중 단계 In Silico 발견Article Published on 2022-06-212022-09-11 Journal: International Journal of Molecular Sciences [Category] [DOI] 10.3390/ijms23136912 PMC 바로가기 [Article Type] Article
In Silico Virtual Screening of Marine Aldehyde Derivatives from Seaweeds against SARS-CoV-2SARS-CoV-2에 대한 해조류의 해양 알데히드 유도체의 실리코 가상 스크리닝Article Published on 2022-06-162022-09-11 Journal: Marine Drugs [Category] [DOI] 10.3390/md20060399 PMC 바로가기 [Article Type] Article
AI-Aided Design of Novel Targeted Covalent Inhibitors against SARS-CoV-2Article Published on 2022-05-252022-10-04 Journal: Biomolecules [Category] [DOI] 10.3390/biom12060746 PMC 바로가기 [Article Type] Article
In silico screening predicts common cold drug Dextromethorphan along with Prednisolone and Dexamethasone can be effective against novel Coronavirus disease (COVID-19)Article Published on 2022-05-012022-10-04 Journal: Journal of biomolecular structure & dynamics [Category] [DOI] 10.1080/07391102.2020.1850528 PMC 바로가기 [Article Type] Article