1 code implementation • 5 Oct 2022 • Jim Boelrijk, Bernd Ensing, Patrick Forré
We also apply and compare our methods to state-of-the-art multi-objective BO methods and EAs on a range of synthetic benchmark test cases.
1 code implementation • NeurIPS 2023 • Lars Holdijk, Yuanqi Du, Ferry Hooft, Priyank Jaini, Bernd Ensing, Max Welling
We consider the problem of sampling transition paths between two given metastable states of a molecular system, e. g. a folded and unfolded protein or products and reactants of a chemical reaction.