Machine Learning Approaches Identify Chemical Features for Stage-Specific Antimalarial Compounds

• Ashleigh van Heerden,
• Gemma Turon,
• Miquel Duran-Frigola,
• Nelishia Pillay,
• Lyn-Marié Birkholtz

Affiliations

Ashleigh van Heerden

Department of Biochemistry, Genetics and Microbiology, Institute for Sustainable Malaria Control, University of Pretoria, Hatfield, South Africa

Gemma Turon

Ersilia Open Source Initiative, Cambridge, U.K.

Miquel Duran-Frigola

Ersilia Open Source Initiative, Cambridge, U.K.

Nelishia Pillay

Department of Computer Science, University of Pretoria, Hatfield, South Africa

Lyn-Marié Birkholtz

Department of Biochemistry, Genetics and Microbiology, Institute for Sustainable Malaria Control, University of Pretoria, Hatfield, South Africa