Constraint-Aware Flow Matching integrates constraint projections into the flow matching training objective to align model dynamics with constrained sampling and reduce distributional shift.
Equivariant diffusion for molecule generation in 3d
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Flow-Direct constructs a reusable non-parametric guidance field from the log-density ratio of base and target distributions using all accumulated reward samples for feedback-efficient guidance in flow models.
DAO pretrains Siamese diffusion-based models on stable/unstable crystal data to achieve 100% experimental match on Cr6Os2 and 2000x speedup over DFT on real superconductors.
MicroWorld constructs a multimodal attributed property graph from scientific image-caption data and augments MLLM prompts via retrieval to raise Qwen3-VL-8B performance by 37.5% on MicroVQA and 6% on MicroBench.
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Constraint-Aware Flow Matching: Decision Aligned End-to-End Training for Constrained Sampling
Constraint-Aware Flow Matching integrates constraint projections into the flow matching training objective to align model dynamics with constrained sampling and reduce distributional shift.
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Flow-Direct: Feedback-Efficient and Reusable Guidance for Flow Models via Non-Parametric Guidance Field
Flow-Direct constructs a reusable non-parametric guidance field from the log-density ratio of base and target distributions using all accumulated reward samples for feedback-efficient guidance in flow models.
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Siamese Foundation Models for Crystal Structure Prediction
DAO pretrains Siamese diffusion-based models on stable/unstable crystal data to achieve 100% experimental match on Cr6Os2 and 2000x speedup over DFT on real superconductors.
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MicroWorld: Empowering Multimodal Large Language Models to Bridge the Microscopic Domain Gap with Multimodal Attribute Graph
MicroWorld constructs a multimodal attributed property graph from scientific image-caption data and augments MLLM prompts via retrieval to raise Qwen3-VL-8B performance by 37.5% on MicroVQA and 6% on MicroBench.