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个人简介
I am an Associate Professor at the Federal University of Goiás, Brazil. I currently direct a research lab with 15 full- and partial-time employees (research associates, postdocs, graduate and undergraduate students). My research focuses on computational drug discovery, cheminformatics, computational toxicology, structural bioinformatics, with the emphasis on drug design for Neglected Tropical Diseases and Cancer, as well as the development of predictive tools to study pharmacokinetics and toxicity properties of chemical compounds, as alternative methods for animal testing. In 2014, I was awarded with the For Women in Science award from L’Oréal-UNESCO and the Brazilian Academy of Sciences in Brazil, and in 2015 with the International Rising Talents award from L’Oréal – UNESCO in France. In 2022 I received the Brazilian Women in Chemistry award from American Chemical Society (ACS) and the Brazilian Society of Chemistry (SBQ). I was elected to the Young Academy of the Brazilian Academy of Sciences (2016-2021), and to the Global Young Academy (GYA, 2020-2023). I served as Associate Editor for the Artificial Intelligence in the Life Sciences (Elsevier) and as Associate Editor of Communications in Chemistry (Nature). Currently, I am Associate Editor of ACS Omega (American Chemical Society). I am Editorial Board Member of the Journal of Chemical Information and Modeling (ACS), Journal of Medicinal Chemistry (ACS) and ChemMedChem (Wiley). As can be gleaned from my list of publications, my research has had a major impact in the area of computational drug discovery where we employ cheminformatics approaches such as QSAR modeling and virtual screening to discover novel bioactive compounds. In recent years, we have expanded our research interest towards computational toxicology. Importantly, we have ported our major software tools and models publicly available in our LabMol portal (www.labmol.com.br).
研究兴趣
论文共 211 篇作者统计合作学者相似作者
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Carolina Andrade,Bruna Katiele de Paula Sousa, Sunniva Sigurdardóttir,Catarina Bourgard,Joyce Borba, Leandro Clementino, Luis Carlos Salazar-Alvarez, Sophia Groustra,Rachael Zigweid, Monique Khim,Bart Staker,Fabio Costa,
Research square (2024)
Lauro Ribeiro de Souza Neto, Bogar Omar Montoya,José Brandão-Neto,Anil Verma, Sebastian Bowyer,José Teófilo Moreira-Filho,Rafael Ferreira Dantas,Bruno Junior Neves,Carolina Horta Andrade, Frank von Delft,Raymond J. Owens,Nicholas Furnham,
Scientific Reportsno. 1 (2024): 1582-1582
Chemical research in toxicologyno. 6 (2024): 910-922
FRONTIERS IN CELLULAR AND INFECTION MICROBIOLOGY (2024)
Kaira C. P. Tomaz,Tatyana A. Tavella,Joyce V. B. Borba, Luis C. Salazar-Alvarez, Joao E. Levandoski,Melina Mottin,Bruna K. P. Sousa,Jose T. Moreira-Filho, Vitor M. Almeida, Leandro C. Clementino,Catarina Bourgard,Katlin B. Massirer,
Jade Milhomem Lemos, Meryck Felipe Brito da Silva, Alexandra Maria dos Santos Carvalho,Henric Pietro Vicente Gil,Vinicius Alexandre Fiaia Costa,Carolina Horta Andrade,Rodolpho Campos Braga,Philippe Grellier,Eugene N. Muratov,Sebastien Charneau,Jose Teofilo Moreira-Filho,Izabela Marques Dourado Bastos,
FUTURE MEDICINAL CHEMISTRYno. 16 (2023): 1449-1467
Marcos Abc Júnior,Lívia C Silva,Olivia B Rocha, Amanda A Oliveira,Igor G Portis,Antonio Alonso,Lais Alonso, Kleber Sf Silva,Marcelo N Gomes,Carolina H Andrade,Célia Ma Soares,Maristela Pereira
Future microbiology (2023)
Jürgen Bajorath, Steve Gardner,Francesca Grisoni,Carolina Horta Andrade,Johannes Kirchmair, Melissa Landon,José L. Medina-Franco,Filip Miljković, Floriane Montantari,Raquel Rodríguez-Pérez
Artificial Intelligence in the Life Sciences (2023): 100088-100088
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