A symmetry-constrained preconditioner maps molecular geometry to VQE circuit parameters in the correlated ground-state basin, cutting initialization errors by 38x to 6250x on stretched molecules.
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OmniMol transfers a billion-jet pre-trained PET foundation model from HEP to molecular dynamics via an interaction-matrix attention bias, delivering strong performance on the oMol dataset with minimal fine-tuning and fast inference.
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Symmetry-Protected Basin Localization in Variational Quantum Eigensolvers
A symmetry-constrained preconditioner maps molecular geometry to VQE circuit parameters in the correlated ground-state basin, cutting initialization errors by 38x to 6250x on stretched molecules.
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OmniMol: Transferring Particle Physics Knowledge to Molecular Dynamics with Point-Edge Transformers
OmniMol transfers a billion-jet pre-trained PET foundation model from HEP to molecular dynamics via an interaction-matrix attention bias, delivering strong performance on the oMol dataset with minimal fine-tuning and fast inference.