ENTITY
molecular design
molecular design
PulseAugur coverage of molecular design — every cluster mentioning molecular design across labs, papers, and developer communities, ranked by signal.
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New MCMC sampler uses preference voting for conditional sampling
Researchers have developed Pref-MH, a novel Markov Chain Monte Carlo (MCMC) sampler that enables exact conditional sampling from distributions defined by semantic properties, even when exact density evaluations are unav…
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AI agents accelerate molecular design for batteries and drug discovery
Researchers have developed new AI agents for molecular design, aiming to accelerate scientific discovery. One agent, CLIO, uses a continuously updated belief-state graph and a recursive plan-then-act loop to recognize w…