Cannabis sativa L. as a Natural Drug Meeting the Criteria of a Multitarget Approach to TreatmentReview Published on 2021-01-142022-10-29 Journal: International Journal of Molecular Sciences [Category] COVID-19, [키워드] Cannabis Bioavailability cannabis Clinical use Compound coronavirus disease Diseases drug epilepsy expressed G protein-coupled receptor glycine group implication include Inflammatory bowel disease knowledge meeting multiplex multitarget natural nausea Pain Parkinson’s disease penetration pharmacological phytocannabinoids (THC and CBD) provide receptor receptors Schizophrenia selected Serotonin structures syndrome synergism synergistic terpenes these compound Treatment TRP vomiting [DOI] 10.3390/ijms22020778 PMC 바로가기 [Article Type] Review
Impact of COVID-19 on Mitochondrial-Based Immunity in Aging and Age-Related DiseasesNeuroscience Published on 2021-01-122022-10-31 Journal: Frontiers in Aging Neuroscience [Category] COVID-19, [키워드] acute respiratory syndrome age aging Alzheimer’s disease cardiovascular disease caused Cell cell death cell immunity chills chronic obstructive Clinical symptoms Comorbidity coronavirus coronavirus disease cough COVID-19 COVID-19 patients diabetes Diabetes Mellitus difficulty breathing Disease progression Evidence Fever headache help highlight homeostasis hypertension immune cells immune response Immunity Impact impair increase Increasing individual infected cell Interaction involved lifestyle likelihood Loss of Smell measure Mitochondria mitochondrial mitochondrial dynamics molecular mechanism Mortality mortality rate Neurological disease obesity Pain pandemic presence of comorbidity PROTECT pulmonary disease replicate Research SARS-CoV-2 Shortness of breath structures susceptible virus with COVID-19 [DOI] 10.3389/fnagi.2020.614650 PMC 바로가기 [Article Type] Neuroscience
CoV3D: a database of high resolution coronavirus protein structuresAcademicSubjects/SCI00010 Published on 2021-01-082022-10-31 Journal: Nucleic Acids Research [Category] COVID-19, [키워드] Analysis antibodies assist Clustering Community complexes conformations coronavirus protein Coronaviruses COVID-19 database effective vaccine Health molecular N-glycosylation neutralizing antibody other coronaviruses Polymorphisms provide receptors Research resource SARS-CoV-2 SARS-CoV-2 protein sequence variability Small molecules spike glycoprotein Structure structure-based design structures therapy Vaccine Vaccine design virus [DOI] 10.1093/nar/gkaa731 PMC 바로가기 [Article Type] AcademicSubjects/SCI00010
Molecular Docking and Molecular Dynamics Aided Virtual Search of OliveNet™ Directory for Secoiridoids to Combat SARS-CoV-2 Infection and Associated Hyperinflammatory ResponsesMolecular Biosciences Published on 2021-01-072022-10-31 Journal: Frontiers in Molecular Biosciences [Category] COVID-19, [키워드] alleviate Anti-inflammatory anti-SARS-CoV-2 therapeutics AutoDock vina blocked combat complex correlated Cys145 docking drugs Dynamics FIVE fraction functional food Health help Hyperinflammatory hyperinflammatory responses IL1β IL6 IL6R indicated Inflammatory cytokine Interaction M pro main protease molecular molecular docking molecular dynamics non-toxic Oleaceae oleuropein olive oil olive secoiridoids Precision predicted Prevent protease receptor Replication residue response RMSD S protein SARS-CoV-2 SARS-CoV-2 entry SARS-COV-2 infection SARS-CoV-2 spike (S) protein stability structures supported the S protein the SARS-CoV-2 therapy TNFR1 TNFα viral disease virtual search [DOI] 10.3389/fmolb.2020.627767 PMC 바로가기 [Article Type] Molecular Biosciences
An epidemic model integrating direct and fomite transmission as well as household structure applied to COVID-19Research Published on 2021-01-052022-10-30 Journal: Journal of Mathematics in Industry [Category] COVID-19, [키워드] accumulating activities applied Asymptomatic Asymptomatic case attribute basic reproductive number calculated Community condition Contact Contamination country COVID-19 dataset death Direct transmission disease Diseases early infection effective Epidemic Final Focusing fomite transmission Germany high risk include individual infection rate inherent intensity Interaction Local mathematical model modulated parameter Parameter estimation physical distancing raise raised reducing sneezes structures susceptible symptomatic the disease Transmission variable [DOI] 10.1186/s13362-020-00097-x PMC 바로가기 [Article Type] Research
An efficient chemical screening method for structure-based inhibitors to nucleic acid enzymes targeting the DNA repair-replication interface and SARS CoV-2DNA 복구-복제 인터페이스 및 SARS CoV-2를 표적으로 하는 핵산 효소에 대한 구조 기반 억제제에 대한 효율적인 화학적 스크리닝 방법Article Published on 2021-01-012022-09-11 Journal: Molecules [Category] Coronavirus, 유전자 메커니즘, [키워드] Absorption ADME ADP-ribose affinity approach approved Cancer cancer cell Cancer cells Cassandra CASSIE Cell Chemical Chemical library Chemistry classical Compound defined distribution DNA DNA replication DNA replication and repair docking drug drug design Drug discovery effective effort enzyme excretion facilitate human protein human proteins increasingly inhibitor inhibitors iterative Mac1 macrodomain mechanism metabolism molecular nonstructural protein 3 Nsp3 nucleic acid optimization PARG Pathogenesis pathway predicted problem profiles protein 3 Proteins provide repair ribose RNA SARS CoV SARS CoV-2 SARS-CoV2 Screen screening method specific inhibitor specific inhibitors Structure structures target to define [DOI] 10.1016/bs.mie.2021.09.003 PMC 바로가기 [Article Type] Article
Weight loss, malnutrition, and cachexia in COVID‐19: facts and numbersEditorial Published on 2020-12-312022-10-29 Journal: Journal of Cachexia, Sarcopenia and Muscle [Category] COVID-19, MERS, SARS, [키워드] Affect C‐reactive protein Cachexia Care Complication contribute Course COVID‐19 COVID‐19 patient COVID‐19 develop disease dysfunction Endocrine Epidemiology Factor fat Fever form Frequency include Inflammation intensive care loss of appetite Malnutrition medical need Occurrence Patient patients Prevent raised renal dysfunction renal function reported Seven severity Specific structures Support the disease the timing therapy tissue treated underweight weight weight loss WHO criteria [DOI] 10.1002/jcsm.12674 PMC 바로가기 [Article Type] Editorial
Interactive Molecular Dynamics in Virtual Reality Is an Effective Tool for Flexible Substrate and Inhibitor Docking to the SARS-CoV-2 Main Protease가상 현실의 대화형 분자 역학은 SARS-CoV-2 메인 프로테아제에 대한 유연한 기질 및 억제제 도킹을 위한 효과적인 도구입니다Article Published on 2020-12-282022-09-11 Journal: Journal of Chemical Information and Modeling [Category] SARS, 변종, 신약개발, 치료제, [키워드] approach backbone binding interactions build Community complexes COVID-19 creating crystal structure crystal structures crystallographic structure demonstrated docked docking Drug development Dynamics effective effort enzyme flexibility flexible focus hydrogen hydrogen bonds inhibitor MD simulation MD simulations Metrics molecular molecular dynamics MPro oligopeptide open physically PLOS protease Protein protein complex protein complexes Protein target protocol provide REALITY recommendation Research RMSD SARS-CoV-2 virus small molecule small molecule drug small molecule drugs software framework Structure structures substrate targets tested the SARS-CoV-2 the SARS-CoV-2 virus user Viral virtual reality [DOI] 10.1021/acs.jcim.0c01030 PMC 바로가기 [Article Type] Article
Surveying the Side-Chain Network Approach to Protein Structure and Dynamics: The SARS-CoV-2 Spike Protein as an Illustrative CaseMolecular Biosciences Published on 2020-12-182022-10-31 Journal: Frontiers in Molecular Biosciences [Category] COVID-19, [키워드] Allostery Analysis approach backbone change conformational change conformational changes conformational dynamics coronavirus criteria described drug design ENhance example functions highlight human cells Ligand Metrics molecular dynamics simulations network network analysis network parameters network theory observé physical Protein protein side-chain network Proteins receptor reveal SARS-CoV-2 SARS-CoV-2 spike protein spike Spike protein Structure structures Surveying the SARS-CoV-2 the spike protein Variation variations [DOI] 10.3389/fmolb.2020.596945 PMC 바로가기 [Article Type] Molecular Biosciences
Nutraceutical Targeting of Inflammation-Modulating microRNAs in Severe Forms of COVID-19: A Novel Approach to Prevent the Cytokine StormReview Published on 2020-12-112022-10-31 Journal: Frontiers in Pharmacology [Category] COVID-19, [키워드] acute lung injury acute respiratory distress acute respiratory syndrome affected alveolar benefit caused condition coronavirus disease COVID-19 cytokine Cytokine storm death dysregulated effective expression form Gene Expression Health Human IL1β IL6 Immune cell Infection Infectious disease Inflammation Inflammatory cytokine Inflammatory response Influenza involved lung Lung injury mechanism micro-RNA microRNA modulate Mortality novel nutraceutical nutraceutics pandemic pathology Prevent recruitment reduce Regulation Sepsis Severe case severe respiratory diseases shown similarity storm structures syndrome targeting the cytokine storm the disease Therapeutic approach TNFα Treatment Vaccine various inflammatory diseases viral infection with COVID-19 [DOI] 10.3389/fphar.2020.602999 PMC 바로가기 [Article Type] Review