van Deursen, Ruud
- GEN: Highly Efficient SMILES Explorer Using Autodidactic Generative Examination Networks
2019/09/10 by Ruud van Deursen, Peter Ertl, van Deursen, Ruud +5 · 1 citation
Computer Science · Materials Science · #Computational Drug Discovery Methods #FOS: Computer and information sciences #Machine Learning (cs.LG) #Machine Learning (stat.ML) #Machine Learning in Materials Science
- Be aware of overfitting by hyperparameter optimization!
2024/07/30 by Tetko, Igor V., van Deursen, Ruud, Godin, Guillaume · 2 citations
#Artificial Intelligence (cs.AI) #FOS: Computer and information sciences #Machine Learning (cs.LG)