المؤلفون: Kamel Mansouri, José T. Moreira-Filho, Charles N. Lowe, Nathaniel Charest, Todd Martin, Valery Tkachenko, Richard Judson, Mike Conway, Nicole C. Kleinstreuer, Antony J. Williams

المصدر: Journal of Cheminformatics, Vol 16, Iss 1, Pp 1-18 (2024)

مصطلحات موضوعية: QSAR-ready, Standardization, Molecular structures, InChI, KNIME, Information technology, T58.5-58.64, Chemistry, QD1-999

وصف الملف: electronic resource

العلاقة: https://doaj.org/toc/1758-2946Test

الوصول الحر: https://doaj.org/article/ca62db38853a477f8e316d435cd15cb9Test

المؤلفون: José T. Moreira-Filho, Rodolpho C. Braga, Jade Milhomem Lemos, Vinicius M. Alves, Joyce V.V.B. Borba, Wesley S. Costa, Nicole Kleinstreuer, Eugene N. Muratov, Carolina Horta Andrade, Bruno J. Neves

المصدر: Artificial Intelligence in the Life Sciences, Vol 1, Iss , Pp 100013- (2021)

مصطلحات موضوعية: Apis mellifera, Artificial intelligence, Pollinators, Ecotoxicology, Machine learning, Predictive modeling, Science (General), Q1-390

وصف الملف: electronic resource

العلاقة: http://www.sciencedirect.com/science/article/pii/S2667318521000131Test; https://doaj.org/toc/2667-3185Test

الوصول الحر: https://doaj.org/article/59a44a6d504f4ad5a3edf955f3796145Test

المؤلفون: José T. Moreira-Filho, Arthur C. Silva, Rafael F. Dantas, Barbara F. Gomes, Lauro R. Souza Neto, Jose Brandao-Neto, Raymond J. Owens, Nicholas Furnham, Bruno J. Neves, Floriano P. Silva-Junior, Carolina H. Andrade

المصدر: Frontiers in Immunology, Vol 12 (2021)

مصطلحات موضوعية: schistosomiasis, drug discovery, artificial intelligence, fragment-based drug discovery, phenotypic screening, target-based screening, Immunologic diseases. Allergy, RC581-607

وصف الملف: electronic resource

العلاقة: https://www.frontiersin.org/articles/10.3389/fimmu.2021.642383/fullTest; https://doaj.org/toc/1664-3224Test

الوصول الحر: https://doaj.org/article/89b83d11b14245f989b852d23dc49be2Test

المؤلفون: Carolina Horta Andrade, Wesley S. Costa, José T. Moreira-Filho, Nicole Kleinstreuer, Jade Milhomem Lemos, Vinicius M. Alves, Bruno J. Neves, Rodolpho C. Braga, Joyce V. V. B. Borba, Eugene N. Muratov

المصدر: Artificial Intelligence in the Life Sciences, Vol 1, Iss, Pp 100013-(2021)

مصطلحات موضوعية: Quantitative structure–activity relationship, Artificial intelligence, Science (General), business.industry, Pollinators, General Medicine, Pesticide, Biology, Ecotoxicology, Acute toxicity, Predictive modeling, Random forest, Honey Bees, Q1-390, Toxicity, Machine learning, Web application, Apis mellifera, business, Applicability domain

الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::17a3d80d8ad5f685bc34e6fdaf761fc5Test
http://www.sciencedirect.com/science/article/pii/S2667318521000131Test

المؤلفون: José T. Moreira-Filho, Amanda de Oliveira Melo, Bruno J. Neves, José Clecildo Barreto Bezerra, Daniela Braz dos Santos, Thiago Lopes Rocha, Carolina Horta Andrade, Josiel Araújo Lemes, Luciana Damacena Silva

المصدر: New Journal of Chemistry. 44:16948-16958

مصطلحات موضوعية: 0303 health sciences, biology, Chemistry, In silico, 030231 tropical medicine, Intermediate host, General Chemistry, Snail, Computational biology, biology.organism_classification, Catalysis, 03 medical and health sciences, 0302 clinical medicine, Molluscicide, biology.animal, Materials Chemistry, medicine, Biomphalaria glabrata, Bioassay, Potency, Niclosamide, 030304 developmental biology, medicine.drug

الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_________::5f066e94fe9b00be5e955d83de5d99f4Test
https://doi.org/10.1039/d0nj03314fTest

المؤلفون: Aline Rimoldi, José T. Moreira-Filho, Joyce V. V. B. Borba, Letícia Tiburcio Ferreira, Fabio T. M. Costa, Carolina Horta Andrade

المصدر: Biomolecules
Volume 11
Issue 3
Biomolecules, Vol 11, Iss 459, p 459 (2021)

مصطلحات موضوعية: Quantitative structure–activity relationship, Physiologically based pharmacokinetic modelling, natural products, In silico, Plasmodium falciparum, lcsh:QR1-502, Quantitative Structure-Activity Relationship, Context (language use), Computational biology, Biology, 01 natural sciences, Biochemistry, lcsh:Microbiology, Article, 03 medical and health sciences, chemistry.chemical_compound, Antimalarials, experimental validation, medicine, Artemisinin, Molecular Biology, 030304 developmental biology, ADME, 0303 health sciences, Virtual screening, Biological Products, Natural product, Quinine, QSAR, virtual screening, Artemisinins, 0104 chemical sciences, 010404 medicinal & biomolecular chemistry, chemistry, medicine.drug

وصف الملف: application/pdf

الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::2e563a55c9835c5245f73d20d9fabebeTest
http://europepmc.org/articles/PMC8003391Test

المؤلفون: Marta L. Lima, Thais A. Costa-Silva, Bruno J. Neves, Carolina Horta Andrade, Andre G. Tempone, Ivanildo A. Brito, José T. Moreira-Filho, Maiara M. Romanelli, Patricia Sartorelli, João Henrique G. Lago, Emerson A. Oliveira

المصدر: Journal of Natural Products. 82:1177-1182

مصطلحات موضوعية: Cell Membrane Permeability, Magnetic Resonance Spectroscopy, Acetogenins, Trypanosoma cruzi, hERG, Annonaceae, Pharmaceutical Science, 01 natural sciences, Analytical Chemistry, Drug Discovery, Amastigote, IC50, Membrane Potential, Mitochondrial, Pharmacology, Membrane potential, chemistry.chemical_classification, Reactive oxygen species, biology, 010405 organic chemistry, Chemistry, Cell Membrane, Organic Chemistry, Depolarization, biology.organism_classification, Trypanocidal Agents, 0104 chemical sciences, 010404 medicinal & biomolecular chemistry, Membrane, Complementary and alternative medicine, Biochemistry, Seeds, biology.protein, Molecular Medicine

الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::ae2c9e423e02ce61cde90895df73c660Test
https://doi.org/10.1021/acs.jnatprod.8b00890Test

المؤلفون: Carolina Andrade, Eugene Muratov, Rodolpho C. Braga, Vinicius Alves, Melina Mottin, Joyce V. V. B. Borba, Arthur C. Silva, José T. Moreira-Filho, Bruno J. Neves

المصدر: Journal of the Brazilian Chemical Society, Volume: 32, Issue: 1, Pages: 110-122, Published: 20 JAN 2021
Journal of the Brazilian Chemical Society v.32 n.1 2021
Journal of the Brazilian Chemical Society
Sociedade Brasileira de Química (SBQ)
instacron:SBQ

مصطلحات موضوعية: machine learning, KNIME, virtual screening, predictive modeling, drug discovery

وصف الملف: text/html

الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::5960d8a99521e60e9d2ff2d405282f60Test
http://www.scielo.br/scielo.php?script=sci_arttext&pid=S0103-50532021000100110&lng=en&tlng=enTest

المؤلفون: Rodolpho C. Braga, Eugene N. Muratov, Arthur C. Silva, Joyce V. V. B. Borba, Vinicius M. Alves, Carolina Horta Andrade, Melina Mottin, Bruno J. Neves, José T. Moreira-Filho

المصدر: Journal of the Brazilian Chemical Society.

مصطلحات موضوعية: Biological data, Virtual screening, business.industry, Computer science, General Chemistry, Machine learning, computer.software_genre, Standalone program, Chemical space, Data-driven, chemistry.chemical_compound, Workflow, chemistry, Cheminformatics, Chemogenomics, Artificial intelligence, business, Protocol (object-oriented programming), computer

الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::c3f320d6a13b44a8778ce185454dff8dTest
https://doi.org/10.21577/0103-5053.20200160Test

المؤلفون: Carolina Horta Andrade, Bruno J. Neves, José T. Moreira-Filho, Sabrina Silva Mendonca, Bruna Katiele de Paula Sousa, Melina Mottin

مصطلحات موضوعية: Flexibility (engineering), Virtual screening, Computer science, Drug discovery, business.industry, Best practice, Machine learning, computer.software_genre, Variety (cybernetics), Docking (dog), Search algorithm, Artificial intelligence, business, computer

الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_________::49d3068aa5f203f2211d50cbf008c6b0Test
https://doi.org/10.1016/b978-0-12-822312-3.00001-1Test