Computational design of new protein kinase 2 inhibitors for the treatment of inflammatory diseases using QSAR, pharmacophore-structure-based virtual screening, and molecular dynamics (2018)
- Authors:
- USP affiliated authors: GIULIATTI, SILVANA - FMRP ; SILVA, CARLOS HENRIQUE TOMICH DE PAULA DA - FCFRP
- Unidades: FMRP; FCFRP
- DOI: 10.1007/s00894-018-3756-y
- Subjects: ANTI-INFLAMATÓRIOS; FARMACOCINÉTICA
- Keywords: Anti-inflammatory drugs; Molecular dynamics; Pharmacokinetic; RIPK2; Toxicological
- Language: Inglês
- Imprenta:
- Publisher place: Heidelberg
- Date published: 2018
- Source:
- Título: Journal of Molecular Modeling
- ISSN: 1610-2940
- Volume/Número/Paginação/Ano: v. 24, n. 9, art. 225, 2018
- Status:
- Artigo possui versão em acesso aberto em repositório (Green Open Access)
- Versão do Documento:
- Versão submetida (Pré-print)
- Acessar versão aberta:
-
ABNT
CRUZ, Josiane Viana et al. Computational design of new protein kinase 2 inhibitors for the treatment of inflammatory diseases using QSAR, pharmacophore-structure-based virtual screening, and molecular dynamics. Journal of Molecular Modeling, v. 24, n. 9, 2018Tradução . . Disponível em: https://doi.org/10.1007/s00894-018-3756-y. Acesso em: 09 abr. 2026. -
APA
Cruz, J. V., Serafim, R. B., Silva, G. M. da, Giuliatti, S., Rosa, J. M. C., Araújo Neto, M. F., et al. (2018). Computational design of new protein kinase 2 inhibitors for the treatment of inflammatory diseases using QSAR, pharmacophore-structure-based virtual screening, and molecular dynamics. Journal of Molecular Modeling, 24( 9). doi:10.1007/s00894-018-3756-y -
NLM
Cruz JV, Serafim RB, Silva GM da, Giuliatti S, Rosa JMC, Araújo Neto MF, Leite FHA, Taft CA, Silva CHT de P da, Santos CBR. Computational design of new protein kinase 2 inhibitors for the treatment of inflammatory diseases using QSAR, pharmacophore-structure-based virtual screening, and molecular dynamics [Internet]. Journal of Molecular Modeling. 2018 ; 24( 9):[citado 2026 abr. 09 ] Available from: https://doi.org/10.1007/s00894-018-3756-y -
Vancouver
Cruz JV, Serafim RB, Silva GM da, Giuliatti S, Rosa JMC, Araújo Neto MF, Leite FHA, Taft CA, Silva CHT de P da, Santos CBR. Computational design of new protein kinase 2 inhibitors for the treatment of inflammatory diseases using QSAR, pharmacophore-structure-based virtual screening, and molecular dynamics [Internet]. Journal of Molecular Modeling. 2018 ; 24( 9):[citado 2026 abr. 09 ] Available from: https://doi.org/10.1007/s00894-018-3756-y - In silico screening for phospholipase A2 of Apis Mellifera with diverset library
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