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Maciej Falkiewicz

2 accepted papers

2025

MING: A Functional Approach to Learning Molecular Generative Models

AISTATS 2025poster

Traditional molecule generation methods often rely on sequence- or graph-based representations, which can limit their expressive power or require complex permutation-equivariant architectures. This paper introduces a novel paradigm for learning molecule generative models based on functional represen…

Cited by 0SourcecodeScholar
2023

Calibrating Neural Simulation-Based Inference with Differentiable Coverage Probability

NeurIPS 2023poster

Bayesian inference allows expressing the uncertainty of posterior belief under a probabilistic model given prior information and the likelihood of the evidence. Predominantly, the likelihood function is only implicitly established by a simulator posing the need for simulation-based inference (SBI).…