Talk at the Workshop on Principles of Generative Modeling (PriGM), EurIPS 2025, Copenhagen. We introduce a formal logical composition framework for conditional diffusion (AND and …
At the 1st SIMBIOCHEM Workshop (Dec 6th, 2025, Copenhagen), Viktor Zaverkin presented our work on augmenting MLIPs with analytic long-range electrostatics and dispersion for …
Performance of Universal Machine-Learned Potentials with Explicit Long-Range Interactions in Biomolecular Simulations accepted for publication in JCTC (ACS). Viktor Zaverkin, …
Fast, Modular, and Differentiable Framework for Machine Learning-Enhanced Molecular Simulations accepted in J. Chem. Phys. PyTorch-based framework for ML-enhanced MD/MC; code at …
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