المؤلفون: Botelho, Fernanda Diniz, Oliveira, Roberta Siqueira Soldaini de, Almeida, Joyce S. F. D. de, França, Tanos C. C., Borges Jr., Itamar

المصدر: Química Nova. February 2021 44(2)

مصطلحات موضوعية: partial atomic charges, distributed multipole analysis, electric dipole moment vector, ricin inhibitors, computational chemistry

وصف الملف: text/html

URL الوصول: http://old.scielo.br/scielo.php?script=sci_arttext&pid=S0100-40422021000200161

المؤلفون: Botelho, Fernanda Diniz, Franca, Tanos Celmar Costa, Laplante, Steven

مصطلحات موضوعية: Drug design, Ribosome-inactivating protein, Ricin inhibitors, chemical warfare, medicinal chemistry, ricin A chain

Relation: Botelho, Fernanda Diniz; Franca, Tanos Celmar Costa et Laplante, Steven ORCID logoorcid:0000-0003-2835-5789 (2024). The Search for Antidotes Against Ricin Mini-Reviews in Medicinal Chemistry . DOI:10.2174/0113895575270509231121060105 . (Sous Presse)

الاتاحة: https://espace.inrs.ca/id/eprint/14332/
https://doi.org/10.2174/0113895575270509231121060105

المؤلفون: Fernanda D. Botelho, Marcelo C. dos Santos, Arlan da S. Gonçalves, Kamil Kuca, Martin Valis, Steven R. LaPlante, Tanos C. C. França, Joyce S. F. D. de Almeida

المصدر: Toxins; Volume 12; Issue 12; Pages: 746

مصطلحات موضوعية: ricin, ricin inhibitors, molecular dynamics, ligand-based virtual screening, chemical/biological warfare agents

جغرافية الموضوع: agris

وصف الملف: application/pdf

Relation: https://dx.doi.org/10.3390/toxins12120746

الاتاحة: https://doi.org/10.3390/toxins12120746

المؤلفون: Botelho, Fernanda D, Santos, Marcelo C, da Silva Goncalves, Arlan, Franca, Tanos Celmar Costa, Laplante, Steven, de Almeida, Joyce S F D

مصطلحات موضوعية: Ricin Inhibitors, Biological Warfare Agents, Drug Repurposing, Ricin, Virtual Screening

Relation: Botelho, Fernanda D, Santos, Marcelo C, da Silva Goncalves, Arlan, Franca, Tanos Celmar Costa, Laplante, Steven orcid:0000-0003-2835-5789 et de Almeida, Joyce S F D (2021). Identification of novel potential ricin inhibitors by virtual screening, molecular docking, molecular dynamics and MM-PBSA calculations: a drug repurposing approach Journal of Biomolecular Structure and Dynamics . DOI:10.1080/07391102.2020.1870154 . (Sous Presse)

الاتاحة: https://espace.inrs.ca/id/eprint/12305/
https://doi.org/10.1080/07391102.2020.1870154

المؤلفون: Marcelo C. dos Santos, Martin Vališ, Tanos C. C. França, Steven R. LaPlante, Fernanda D. Botelho, Arlan da Silva Gonçalves, Joyce S. F. D. de Almeida, Kamil Kuca

المصدر: Toxins
Toxins, Vol 12, Iss 746, p 746 (2020)
Volume 12
Issue 12

مصطلحات موضوعية: ligand-based virtual screening, Health, Toxicology and Mutagenesis, 030303 biophysics, Molecular Conformation, lcsh:Medicine, Ricin, Molecular Dynamics Simulation, Toxicology, Ligands, Molecular mechanics, Article, 03 medical and health sciences, Molecular dynamics, chemistry.chemical_compound, Drug Discovery, Molecule, Chemical Warfare Agents, 030304 developmental biology, 0303 health sciences, Virtual screening, ricin inhibitors, Binding Sites, Molecular Structure, Chemistry, lcsh:R, Hydrogen Bonding, Combinatorial chemistry, molecular dynamics, Molecular Docking Simulation, chemical/biological warfare agents, Docking (molecular), PubChem, Algorithms

وصف الملف: application/pdf

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::9a6ba20ac0717a0646e320652e104191
http://europepmc.org/articles/PMC7761309

المؤلفون: Tanos C. C. França, Fernanda D. Botelho, Roberta Siqueira Soldaini de Oliveira, Joyce S. F. D. de Almeida, Itamar Borges

المصدر: Química Nova, Volume: 44, Issue: 2, Pages: 161-171, Published: 07 MAY 2021
Química Nova v.44 n.2 2021
Química Nova
Sociedade Brasileira de Química (SBQ)
instacron:SBQ
Química Nova, Vol 44, Iss 2, Pp 161-171 (2021)

مصطلحات موضوعية: Chemistry, ricin inhibitors, partial atomic charges, General Chemistry, QD1-999, distributed multipole analysis, electric dipole moment vector, computational chemistry

وصف الملف: text/html

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::b46f51cd30231f23cfa5df731018db2e
https://doi.org/10.21577/0100-4042.20170683