Results 121 to 130 of about 452,971 (205)

Structure‐ and Ligand‐Based Discovery of Novel 3‐Chymotrypsin‐Like Protease Nonpeptidomimetic Hits

ChemMedChem, Volume 21, Issue 7, 14 April 2026.
A multistep virtual screening cascade, integrating shape‐based, ensemble docking, and quantitative structure–activity relationship (QSAR) models, was employed to screen 1.5 million compounds. This funnel identified a novel 3‐chymotrypsin‐like protease (3CLpro) inhibitor, LabMol‐499, which was experimentally validated using a Förster Resonance Energy ...
Sabrina Silva‐Mendonça, Donald Seanego, Christopher Jurisch, Melina Mottin, Flávia Nader Motta, Beatriz S. A. Rodrigues, Gilberto S. M. Junior, Alexandra Maria dos Santos Carvalho, Fábio Muniz de Oliveira, Sunniva Sigurdardóttir, Per Sunnerhagen, Izabela Marques Dourado Bastos, Richard Gessner, Kelly Chibale, Carolina Horta Andrade   +14 more
wiley   +1 more source

ViralQuest: a user-friendly interactive pipeline for viral-sequences analysis and curation. [PDF]

BMC Bioinformatics
Rodrigues GVP, Ferreira LYM, Aguiar ERGR.   +2 more
europepmc   +1 more source

Open data phylometabolomics reveals turnover-dominated chemical divergence and clade-specific physicochemical regimes across angiosperms. [PDF]

Plant J
Carollo CA, Boaretto AG, Nocetti MC, Carollo ARH, Alves FM.   +4 more
europepmc   +1 more source

OmniBio: an easy-to-use web app for kinetic growth parameter calculation from microplate reader data. [PDF]

Bioinform Adv
Dehnhardt-Amengual S, Ardiles C, Guarda I, Achiardi-Letelier I, Larrondo LF, Mardones W.   +5 more
europepmc   +1 more source

In silico conversion of ssRNA aptamers to ssDNA: molecular dynamics assessment of structural stability and conformational preservation. [PDF]

J Comput Aided Mol Des
Lorenti S, Alqualo NO, Moreira DC, Junior NN, Goulart VA.   +4 more
europepmc   +1 more source

Gestão de Documentos e meio digital : um posicionamento urgente e estratégico [PDF]

, 2013
Maria Manuela Pinto
core  

Loop-Mediated Isothermal Amplification (LAMP) for the Diagnosis of High-Burden Viral Diseases in Resource-Limited Countries. [PDF]

Pathogens
Vasconcelos-Martins AC, Giovanetti M, Elias MC, Slavov SN, Sampaio SC.   +4 more
europepmc   +1 more source

Identification and Structural Elucidation of a New Synthetic Cannabinoid, MDMB-5'Br-PINACA, in Seized Herbal Materials. [PDF]

Drug Test Anal
de Godoi AB, Zeoly LA, Lanaro R, Oliveira IS, Diana MC, Yonamine M, Costa JL.   +6 more
europepmc   +1 more source

Immune system up-regulation in securely attached infants during early childhood. [PDF]

Brain Behav Immun Health
González-Puelma J, Sarmiento Varón L, Vidal J, Ceroni C, Escobedo S, Uribe-Paredes R, Medina-Ortiz D, Cárcamo RA, Navarrete MA.   +8 more
europepmc   +1 more source

Mono- and Polyauxic Growth Kinetics: A Semi-Mechanistic Framework for Complex Biological Dynamics. [PDF]

Bull Math Biol
Mockaitis G.
europepmc   +1 more source