Browsing by Subject "Molecular docking"

1,4-Naphthoquinones potently inhibiting P2X7 receptor activity

Faria, R. X. et al. | Date Issued: 2018

An investigation into the interaction between piplartine (piperlongumine) and human serum albumin

Contessoto, Nayara Sousa de Alcântara et al. | Date Issued: 2019

Análise de aspectos estruturais em imunoinformática utilizando candidatos vacinais contra Leishmaniose que foram selecionados usando vacinologia reversa

Velloso, João Paulo Linhares | Date Issued: 2018

As leishmanioses são um conjunto de doenças causadas por parasitos do gênero Leishmania. A leishmaniose cutânea no Brasil é causada principalmente pela espécie Leishmania braziliensis enquanto a leishmaniose visceral é ...

Antibacterial Activity of 2-Amino-1,4-naphthoquinone Derivatives against Gram-Positive and Gram-Negative Bacterial Strains and Their Interaction with Human Serum Albumin

Silva, Carla C. da et al. | Date Issued: 2020

Atazanavir Is a Competitive Inhibitor of SARS-CoV-2Mpro, Impairing Variants Replication In Vitro and In Vivo

Chaves, Otávio Augusto et al. | Date Issued: 2022

Commercially Available Flavonols Are Better SARS-CoV-2 Inhibitors than Isoflavone and Flavones

Chaves, Otávio Augusto et al. | Date Issued: 2022

Comparative molecular docking analysis among six scFv monoclonal antibodies against hepatitis B virus surface antigen

Dias, Artur Hermano Sampaio et al. | Date Issued: 2016

Design, synthesis and cruzain docking of 3-(4-substituted-aryl)-1,2,4-oxadiazole-N-acylhydrazones as anti-Trypanosoma cruzi agents

Santos Filho, José Maurício dos et al. | Date Issued: 2009

Design, synthesis, in vitro and in silico studies of novel 4-oxoquinoline ribonucleoside derivatives as HIV-1 reverse transcripase inihibitors

Forezi, Luana da S. M. et al. | Date Issued: 2020

Development of New Potential Inhibitors of 1 Integrins through In Silico Methods—Screening and Computational Validation

Vasconcelos, Disraeli et al. | Date Issued: 2022

Evaluation of 7-arylaminopyrazolo[1,5-a]pyrimidines as anti-Plasmodium falciparum, antimalarial, and Pf-dihydroorotate dehydrogenase inhibitors

Azeredo, Luís Felipe S. P. et al. | Date Issued: 2017

Fluorine Atoms on C6H5-Corrole Affect the Interaction with Mpro and PLpro Proteases of SARS-CoV-2: Molecular Docking and 2D-QSAR Approaches

Chaves, Otávio Augusto et al. | Date Issued: 2022

In silico identification of inhibitors of ribose 5-phosphate isomerase from Trypanosoma cruzi using ligand and structure based approaches

Sinatti, Vanessa de V. C. et al. | Date Issued: 2017

In Silico Insights into the Mechanism of Action of Epoxy-α-Lapachone and Epoxymethyl-Lawsone in Leishmania spp.

Peixoto, Juliana Figueiredo et al. | Date Issued: 2021

In silico search of Myrcia tomentosa (Myrtaceae) antineoplastic potential

Rodrigues, Júlia Alves Nascimento et al. | Date Issued: 2022

Inhibition of digestive enzymes (α-amylase, αglucosidase, lipase, trypsin) by aqueous Hibiscus sabdariffa L. (Malvaceae) extract

Carvalho, Caio Eduardo de et al. | Date Issued: 2022

Molecular basis of Tityus stigmurus alpha toxin and potassium channel kV1.2 interactions

Freire, Marjorie Caroline Liberato Cavalcanti et al. | Date Issued: 2018

Recent insights on the medicinal chemistry of metal-based compounds: hints for the successful drug design

Hernandes, M. Z. et al. | Date Issued: 2010

Screening organic repellent compounds against lutzomyia longipalpis (Diptera: Psychodidae) present in plant essential oils: bioassay plus an in silico approach

Mota, Tiago F et al. | Date Issued: 2022

Nas Américas, Lutzomyia longipalpis é a espécie de mosca de areia mais relevante para a transmissão de leishmaniose visceral. Para o controle vetorial no Brasil, a pulverização de inseticidas não tem mostrado redução ...

Structural insights into NS5B protein of novel equine hepaciviruses and pegiviruses complexed with polymerase inhibitors

Albuquerque, Pedro Pereira Lira Furtado de et al. | Date Issued: 2020