Machine Learning for Small Molecules

IBSE is pleased to invite you to the 12th IBSE Colloquium. In this instance Prof. Juho Rousu will about Machine Learning for Small Molecules. Small molecules have a pivotal role in many applications in life sciences, including biomedicine and drug discovery, enviromental sciences and biotechnology. At the same time, the emergence of large open datasets is fuelling the development of new machine learning technologies. Prof. Juho Rousu will discuss a generic machine learning task of predicting the a compatibility score F(x,y) of a pair of objects x and y, or in general a set of multiple interacting objects. Machine learning tasks such as predicting structured output, link prediction in networks as well as multi-variate association analysis in paired datasets falls under this umbrella.