Chemoinformatics and artificial intelligence colloquium: progress and challenges in developing bioactive compounds

Registro completo de metadados
MetadadosDescriçãoIdioma
Autor(es): dc.contributorRheinische Friedrich-Wilhelms-Universität-
Autor(es): dc.contributorNational Autonomous University of Mexico-
Autor(es): dc.contributorErsilia Open Source Initiative-
Autor(es): dc.contributorThe Barcelona Institute of Science and Technology-
Autor(es): dc.contributorInternational Iberian Nanotechnology Laboratory-
Autor(es): dc.contributorUniversity of Erlangen-Nuremberg-
Autor(es): dc.contributorCenter for Research and Advanced Studies of the National Polytechnic Institute (CINVESTAV)-
Autor(es): dc.contributorUniversity of Arizona-
Autor(es): dc.contributorRecursion Pharmaceuticals-
Autor(es): dc.contributorParc Cientific de Barcelona (PCB)-
Autor(es): dc.contributorParc de Recerca Biomedica (PRBB)-
Autor(es): dc.contributorUniversity of Florida-
Autor(es): dc.contributorUniversity of New Mexico School of Medicine-
Autor(es): dc.contributorSahlgrenska Academy at Gothenburg University-
Autor(es): dc.contributorUniversity of Copenhagen-
Autor(es): dc.contributorInc.-
Autor(es): dc.contributorIrapuato Unit-
Autor(es): dc.contributorNovartis Institutes for Biomedical Research-
Autor(es): dc.contributorInstituto de Investigación Masira-
Autor(es): dc.contributorUniversidad Nacional Autónoma de México-
Autor(es): dc.contributorUniversidade Estadual Paulista (UNESP)-
Autor(es): dc.creatorBajorath, Jürgen-
Autor(es): dc.creatorChávez-Hernández, Ana L.-
Autor(es): dc.creatorDuran-Frigola, Miquel-
Autor(es): dc.creatorFernández-de Gortari, Eli-
Autor(es): dc.creatorGasteiger, Johann-
Autor(es): dc.creatorLópez-López, Edgar-
Autor(es): dc.creatorMaggiora, Gerald M.-
Autor(es): dc.creatorMedina-Franco, José L.-
Autor(es): dc.creatorMéndez-Lucio, Oscar-
Autor(es): dc.creatorMestres, Jordi-
Autor(es): dc.creatorMiranda-Quintana, Ramón Alain-
Autor(es): dc.creatorOprea, Tudor I.-
Autor(es): dc.creatorPlisson, Fabien-
Autor(es): dc.creatorPrieto-Martínez, Fernando D.-
Autor(es): dc.creatorRodríguez-Pérez, Raquel-
Autor(es): dc.creatorRondón-Villarreal, Paola-
Autor(es): dc.creatorSaldívar-Gonzalez, Fernanda I.-
Autor(es): dc.creatorSánchez-Cruz, Norberto-
Autor(es): dc.creatorValli, Marilia-
Data de aceite: dc.date.accessioned2025-08-21T21:27:19Z-
Data de disponibilização: dc.date.available2025-08-21T21:27:19Z-
Data de envio: dc.date.issued2023-07-29-
Data de envio: dc.date.issued2023-07-29-
Data de envio: dc.date.issued2022-11-30-
Fonte completa do material: dc.identifierhttp://dx.doi.org/10.1186/s13321-022-00661-0-
Fonte completa do material: dc.identifierhttp://hdl.handle.net/11449/247981-
Fonte: dc.identifier.urihttp://educapes.capes.gov.br/handle/11449/247981-
Descrição: dc.descriptionWe report the main conclusions of the first Chemoinformatics and Artificial Intelligence Colloquium, Mexico City, June 15–17, 2022. Fifteen lectures were presented during a virtual public event with speakers from industry, academia, and non-for-profit organizations. Twelve hundred and ninety students and academics from more than 60 countries. During the meeting, applications, challenges, and opportunities in drug discovery, de novo drug design, ADME-Tox (absorption, distribution, metabolism, excretion and toxicity) property predictions, organic chemistry, peptides, and antibiotic resistance were discussed. The program along with the recordings of all sessions are freely available at https://www.difacquim.com/english/events/2022-colloquium/.-
Descrição: dc.descriptionDirección General de Asuntos del Personal Académico, Universidad Nacional Autónoma de México-
Descrição: dc.descriptionInstituto de Biología, Universidad Nacional Autónoma de México-
Descrição: dc.descriptionInstituto de Geología, Universidad Nacional Autónoma de México-
Descrição: dc.descriptionInstituto de Investigaciones Biomédicas, Universidad Nacional Autónoma de México-
Descrição: dc.descriptionInstituto de Ecología, Universidad Nacional Autónoma de México-
Descrição: dc.descriptionUniversidad Nacional Autónoma de México-
Descrição: dc.descriptionDepartment of Life Science Informatics B-IT LIMES Program Unit Chemical Biology and Medicinal Chemistry Rheinische Friedrich-Wilhelms-Universität, Friedrich-Hirzebruch-Allee 5/6-
Descrição: dc.descriptionDIFACQUIM Research Group Department of Pharmacy School of Chemistry National Autonomous University of Mexico-
Descrição: dc.descriptionErsilia Open Source Initiative-
Descrição: dc.descriptionJoint IRB-BSC-CRG Programme in Computational Biology Institute for Research in Biomedicine (IRB Barcelona) The Barcelona Institute of Science and Technology, Catalonia-
Descrição: dc.descriptionNanosafety Laboratory International Iberian Nanotechnology Laboratory-
Descrição: dc.descriptionComputer-Chemie-Centrum University of Erlangen-Nuremberg-
Descrição: dc.descriptionDepartment of Pharmacology Center for Research and Advanced Studies of the National Polytechnic Institute (CINVESTAV)-
Descrição: dc.descriptionBIO5 Institute University of Arizona-
Descrição: dc.descriptionRecursion Pharmaceuticals-
Descrição: dc.descriptionChemotargets SL Baldiri Reixac 4 Parc Cientific de Barcelona (PCB), Catalonia-
Descrição: dc.descriptionResearch Group on Systems Pharmacology Research Program on Biomedical Informatics (GRIB) IMIM Hospital del Mar Medical Research Institute and University Pompeu Fabra Parc de Recerca Biomedica (PRBB), Catalonia-
Descrição: dc.descriptionDepartment of Chemistry University of Florida-
Descrição: dc.descriptionDepartment of Internal Medicine University of New Mexico School of Medicine-
Descrição: dc.descriptionDepartment of Rheumatology and Inflammation Research Institute of Medicine Sahlgrenska Academy at Gothenburg University-
Descrição: dc.descriptionNovo Nordisk Foundation Center for Protein Research Faculty of Health and Medical Sciences University of Copenhagen-
Descrição: dc.descriptionRoivant Discovery Sciences Inc., 451 D Street-
Descrição: dc.descriptionDepartment of Biotechnology and Biochemistry Center for Research and Advanced Studies of the National Polytechnic Institute (CINVESTAV-IPN) Irapuato Unit, Gto-
Descrição: dc.descriptionChemistry Institute National Autonomous University of Mexico-
Descrição: dc.descriptionNovartis Institutes for Biomedical Research-
Descrição: dc.descriptionUniversidad de Santander Facultad de Ciencias Médicas y de la Salud Instituto de Investigación Masira, Calle 70 No. 55-210, Bucaramanga-
Descrição: dc.descriptionInstituto de Química Unidad Mérida Universidad Nacional Autónoma de México, Carretera Mérida-Tetiz Km. 4.5, Yucatán-
Descrição: dc.descriptionNuclei of Bioassays Biosynthesis and Ecophysiology of Natural Products (NuBBE) Department of Organic Chemistry Institute of Chemistry São Paulo State University-UNESP-
Descrição: dc.descriptionNuclei of Bioassays Biosynthesis and Ecophysiology of Natural Products (NuBBE) Department of Organic Chemistry Institute of Chemistry São Paulo State University-UNESP-
Idioma: dc.languageen-
Relação: dc.relationJournal of Cheminformatics-
???dc.source???: dc.sourceScopus-
Palavras-chave: dc.subjectADME profile-
Palavras-chave: dc.subjectAntibiotic resistance-
Palavras-chave: dc.subjectArtificial intelligence-
Palavras-chave: dc.subjectCareer development-
Palavras-chave: dc.subjectDrug discovery-
Palavras-chave: dc.subjectLigand-based drug design-
Palavras-chave: dc.subjectMachine learning-
Palavras-chave: dc.subjectNatural products-
Palavras-chave: dc.subjectPeptides-
Palavras-chave: dc.subjectStructure-based drug design-
Palavras-chave: dc.subjectVirtual screening-
Título: dc.titleChemoinformatics and artificial intelligence colloquium: progress and challenges in developing bioactive compounds-
Tipo de arquivo: dc.typelivro digital-
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