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Miguel García-Ortegón
Miguel García-Ortegón
Verified email at cam.ac.uk
Title
Cited by
Cited by
Year
Characterization of Atg38 and NRBF2, a fifth subunit of the autophagic Vps34/PIK3C3 complex
Y Ohashi, N Soler, M García Ortegón, L Zhang, ML Kirsten, O Perisic, ...
Autophagy 12 (11), 2129-2144, 2016
672016
DOCKSTRING: easy molecular docking yields better benchmarks for ligand design
M García-Ortegón, GNC Simm, AJ Tripp, JM Hernández-Lobato, A Bender, ...
Journal of chemical information and modeling 62 (15), 3486-3502, 2022
482022
Achieving robustness to aleatoric uncertainty with heteroscedastic Bayesian optimisation
RR Griffiths, AA Aldrick, M Garcia-Ortegon, V Lalchand
Machine Learning: Science and Technology 3 (1), 015004, 2021
312021
Applications of artificial intelligence in drug design: opportunities and challenges
M Thomas, A Boardman, M Garcia-Ortegon, H Yang, C de Graaf, ...
Artificial Intelligence in Drug Design, 1-59, 2022
202022
Heteroscedastic Bayesian optimisation in scientific discovery
RR Griffiths, AA Aldrick, GO Miguel, AA Lee
NeurIPS Workshop on Machine Learning and the Physical Sciences, 2019
32019
Insights into Drug Cardiotoxicity from Biological and Chemical Data: The First Public Classifiers for FDA DICTrank
S Seal, O Spjuth, L Hosseini-Gerami, M García-Ortegón, S Singh, ...
BioRxiv, 2023
22023
Conditional neural processes for molecules
M Garcia-Ortegon, A Bender, S Bacallado
arXiv preprint arXiv:2210.09211, 2022
22022
Insights into Drug Cardiotoxicity from Biological and Chemical Data: The First Public Classifiers for FDA Drug-Induced Cardiotoxicity Rank
S Seal, O Spjuth, L Hosseini-Gerami, M García-Ortegón, S Singh, ...
Journal of Chemical Information and Modeling, 2024
12024
Combining variational autoencoder representations with structural descriptors improves prediction of docking scores
M Garcia-Ortegon, A Bender, CE Rasmussen, H Kajino, S Bacallado
corpus 6, 2, 2020
12020
Antifragile and Robust Heteroscedastic Bayesian Optimisation
R Rhys-Griffiths, M Garcia-Ortegon, AA Aldrick
2019
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Articles 1–10