VASR separates continuation and residual variance in reward-guided diffusion SMC, using optimal mass allocation and systematic resampling to achieve up to 26% better FID scores and faster runtimes than prior SMC and MCTS methods.
Springer New York
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Feynman-Kac steering of RFdiffusion with ProteinMPNN-based guiding potentials improves predicted interface energetics and raises binder designability by 89.5%.
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VASR: Variance-Aware Systematic Resampling for Reward-Guided Diffusion
VASR separates continuation and residual variance in reward-guided diffusion SMC, using optimal mass allocation and systematic resampling to achieve up to 26% better FID scores and faster runtimes than prior SMC and MCTS methods.
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Controllable protein design with particle-based Feynman-Kac steering
Feynman-Kac steering of RFdiffusion with ProteinMPNN-based guiding potentials improves predicted interface energetics and raises binder designability by 89.5%.