Search Results for author: Vitali Nesterov

Found 3 papers, 1 papers with code

Learning Invariances with Generalised Input-Convex Neural Networks

no code implementations14 Apr 2022 Vitali Nesterov, Fabricio Arend Torres, Monika Nagy-Huber, Maxim Samarin, Volker Roth

These networks represent functions that are guaranteed to have connected level sets forming smooth manifolds on the input space.

3DMolNet: A Generative Network for Molecular Structures

no code implementations8 Oct 2020 Vitali Nesterov, Mario Wieser, Volker Roth

With the recent advances in machine learning for quantum chemistry, it is now possible to predict the chemical properties of compounds and to generate novel molecules.

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