Info
- Utilizzare la checkbox di selezione a fianco di ciascun documento per attivare le funzionalità di stampa, invio email, download nei formati disponibili del (i) record.
Computational Approaches: Drug Discovery and Design in Medicinal Chemistry and Bioinformatics
| Computational Approaches: Drug Discovery and Design in Medicinal Chemistry and Bioinformatics |
| Autore | Tutone Marco |
| Pubbl/distr/stampa | Basel, Switzerland, : MDPI - Multidisciplinary Digital Publishing Institute, 2021 |
| Descrizione fisica | 1 online resource (387 p.) |
| Soggetto topico |
Chemistry
Research & information: general |
| Soggetto non controllato |
3CL-Pro
3D-QSAR acetylcholinesterase aging progression mechanism Alzheimer's disease aminophenylbenzamide antibody:antigen interactions antivirals binding free energies binding site binding space carbon nanotubes cholesterol computational biology consensus models COVID-19 COX-2 inhibitors deep learning diabetes docking simulations doxorubicin encapsulation drug delivery system drug discovery drug repositioning drug repositioning approaches drug repurposing drug resistance drug-resistance mutations dual mode of action dual-target lead discovery epitope binning epitope mapping epitope prediction FimH fingerprints gene expression signature genome-wide genetic and epigenetic network (GWGEN) glycoprotein D (gD) haeckelite defects HDACs hERG toxicity herpes simplex virus fusion proteins high-throughput virtual screening HIV-2 protease homology modeling hTSPO human dihydrofolate reductase immunoproteasome in silico induced structural deformations induced-fit docking inhibitors isoform-selective histone deacetylase inhibitors isomeric space ligand-based model machine learning main protease MD binding MD simulation metadynamics methotrexate molecular docking molecular dynamics molecular dynamics (MD) simulation molecular dynamics simulation molecular dynamics simulations molecular modeling MRP4 multi-modal multiple-molecule drug multiprotein inhibiting natural compounds multiscale multitargeting mutants Mycobacterium tuberculosis n/a natural compounds neurodegenerative disorders nicotinic acetylcholine receptor non-covalent inhibitors noncovalent interactions oxidative stress PF-00835231 pharmacophore model pharmacophore modeling PK11195 polypharmacology proteasome protein docking protein threading modeling proteomic signature RNA expression regulation SARS-CoV-2 skin aging SNPs sodium-glucose co-transporters 2 Src inhibitors Stone-Wales defects structural bioinformatics structural characterization systems medicine design tuberculosis urinary tract infections uropathogenic bacteria variants virtual screening |
| Formato | Materiale a stampa  |
| Livello bibliografico | Monografia |
| Lingua di pubblicazione | eng |
| Altri titoli varianti | Computational Approaches |
| Record Nr. | UNINA-9910557519403321 |
Tutone Marco
|
||
| Basel, Switzerland, : MDPI - Multidisciplinary Digital Publishing Institute, 2021 | ||
| Materiale a stampa | ||
| Lo trovi qui: Univ. Federico II | ||
| ||
Marine Drug Research in China: Selected Papers from the 15-NASMD Conference
| Marine Drug Research in China: Selected Papers from the 15-NASMD Conference |
| Autore | Zhou Xuefeng |
| Descrizione fisica | 1 online resource (512 p.) |
| Soggetto topico | Medicine and Nursing |
| Soggetto non controllato |
absolute configuration
AChE inhibitory actinomycete actinomycin D actinomycin X2 adenosine monophosphate-activated protein kinase (AMPK) ADME ADMET adsorption kinetics and isotherms angiotensin-I-converting enzyme (ACE) peptide Antarctic krill (Euphausia superba) anti-glioma activity anti-inflammatory activity antiaging antibacterial antibacterial activity antibacterial properties anticancer antihyperlipidemic antimicrobial activity antimicrobial peptides antioxidant activity antitumor activity antitumor peptide apoptosis Arca inflata aromatic acids ascidian-derived fungus Aspergillus flavipes HN4-13 Aspergillus hiratsukae Aspergillus puniceus Aspergillus sclerotiorum Aspergillus sp Aspergillus terreus Aspergillus unguis biological activities butenolides butyrolactone I Caenorhabditis elegans calmodulin CDK4/6 chejuenlide chronic kidney disease clavipitacae cognitive dysfunction colorectal cancer coral-derived fungi cyclic pentapeptide cytotoxic activity cytotoxicity deep-sea actinomycetes deep-sea fungus deep-sea-derived fungus depsides depsidones Diaporthe sp drug design dyeing emodin enantiomers endothelin-1 (ET-1) enrichment eremophilane sesquiterpenoids flavonoid fluorescent properties food allergy fucoidan fucoxanthin galaxamide analogues genome mining geodin GSK3β-Nrf2-HO-1 signaling Hahella heterocornols IL-17 pathway insecticidal activity isoquinoline alkaloid LC-MS/MS Lecanicillium fusisporum lipodepsipeptide macroporous resin XAD-16 mangrove endophytic Pestalotiopsis mangrove-derived fungus MAPK signaling marine compounds marine fungi mechanism meroterpenoids metabolism methicillin-resistant Staphylococcus aureus microbial pigments microbiota microglial polarization mm-pbsa molecular docking molecular dynamics mutants NAFLD nasopharyngeal carcinoma neuroinflammation nitric oxide (NO) Nrf2 nuclear factor erythroid-2-related factor 2-mediated (Nrf2) Oceanapia osteoclast differentiation oxidative stress oxidized low-density lipoprotein oximes oyster pancreatic lipase PD-L1 Penicillium sp peptide peptidome Pestalotiopsis heterocornis pharmacokinetics pharmacophore construction pharmacophore modeling phycocyanin piericidins plasma prodiginine protein tyrosine phosphatase inhibitor pyranodipyran derivatives sclerotides Sdy-1 secondary metabolites semisynthesize sesquiterpene glycoside signaling pathway silk skipjack tuna (Katsuwonus pelamis) muscle soft-coral-derived fungus Sonneratia apetala sponge sponge-derived fungus stability Streptomyces parvulus tetramic acid derivatives Toll-like receptor 4-mediated (TLR4) transcriptome Trichoderma longibrachiatum tyrosyl DNA phosphodiesterase 1 inhibitory activities vascular endothelial cell virtual screening Wnt signaling xanthones β-catenin |
| Formato | Materiale a stampa |
| Livello bibliografico | Monografia |
| Lingua di pubblicazione | eng |
| Altri titoli varianti | Marine Drug Research in China |
| Record Nr. | UNINA-9910595071903321 |
|
Zhou Xuefeng
|
||
| Materiale a stampa | ||
| Lo trovi qui: Univ. Federico II | ||
| ||