Kurt De Grave
Flanders Make (Belgium)(BE)
Publications by Year
Research Areas
Computational Drug Discovery Methods, Machine Learning in Materials Science, Metabolomics and Mass Spectrometry Studies, Computability, Logic, AI Algorithms, Membrane Separation Technologies
Most-Cited Works
- Fast Neighborhood Subgraph Pairwise Distance Kernel(2010)
- → Cheaper faster drug development validated by the repositioning of drugs against neglected tropical diseases(2015)157 cited
- → kLog: A language for logical and relational learning with kernels(2014)49 cited
- → Optimization of cellulose acetate nanofiltration membranes for micropollutant removal via genetic algorithms and high throughput experimentation(2010)41 cited
- → Active Learning for High Throughput Screening(2008)29 cited
- → Molecular Graph Augmentation with Rings and Functional Groups(2010)15 cited
- The Dawn of Software Engineering: from Turing to Dijkstra(2012)
- Pluralism in Software Engineering: Turing Award Winner Peter Naur Explains(2011)
- → Multi-objective optimization with surrogate trees(2013)7 cited
- Active learning for primary drug screening(2008)