Novel inhibitor discovery for influenza virus neuraminidase
A multi-target screening approach connects molecular prediction with in vitro antiviral investigation.
Read the study: Novel inhibitor discovery for influenza virus neuraminidaseThe science behind the next possibility.
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Benchmarking a novel in silico pipeline for TYK2 inhibitor discovery
An ultra-large library and a known-active comparison put a screening pipeline to the test.
Read the study: Benchmarking a novel in silico pipeline for TYK2 inhibitor discoveryScientific publications.
Publications featured by Biocentric. Follow each source for authorship, methods and publication details.
PocketMaster provides a flexible and automated tool for analyzing, clustering, and visualizing structural diversity in protein pockets (opens in a new tab)
nature.comMulti-target computational pipeline for discovery of pan-influenza neuraminidase inhibitors (opens in a new tab)
frontiersin.orgA new microtubule-stabilizing agent shows potent antiviral effects against African swine fever virus with no cytotoxicity (opens in a new tab)
tandfonline.comStrawberry and Ginger Silver Nanoparticles as Potential Inhibitors for SARS-CoV-2 Assisted by In Silico Modeling and Metabolic Profiling (opens in a new tab)
mdpi.comTargeting 3CLpro and SARS-CoV-2 RdRp by Amphimedon sp. Metabolites: A Computational Study (opens in a new tab)
mdpi.comA New CDK2 Inhibitor with 3-Hydrazonoindolin-2-One Scaffold Endowed with Anti-Breast Cancer Activity: Design, Synthesis, Biological Evaluation, and In Silico Insights (opens in a new tab)
mdpi.comAED-Net: A Single Image Dehazing (opens in a new tab)
ieeexplore.ieee.orgDesign, Synthesis and Anticancer Profile of New 4-(1H-benzo[d]imidazol-1-yl)pyrimidin-2-amine-Linked Sulfonamide Derivatives with V600EBRAF Inhibitory Effect (opens in a new tab)
mdpi.comCombination of consensus and ensemble docking strategies for the discovery of human dihydroorotate dehydrogenase inhibitors (opens in a new tab)
nature.comIdentification of non-classical hCA XII inhibitors using combination of computational approaches for drug design and discovery (opens in a new tab)
nature.comSoybean-associated endophytic fungi as potential source for anti-COVID-19 metabolites supported by docking analysis (opens in a new tab)
enviromicro-journals.onlinelibrary.wiley.comMultitarget in silico studies of Ocimum menthiifolium, family Lamiaceae against SARS-CoV-2 supported by molecular dynamics simulation (opens in a new tab)
tandfonline.comA Network Pharmacology Analysis of Cytotoxic Triterpenes Isolated from Euphorbia abyssinica Latex Supported by Drug-likeness and ADMET Studies (opens in a new tab)
pubs.acs.orgIn silico study of colchicine resistance molecular mechanisms caused by tubulin structural polymorphism (opens in a new tab)
journals.plos.orgNatural antimicrobial peptides as a source of new antiviral agents (opens in a new tab)
microbiologyresearch.org
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