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DeepRHP: A Hybrid Variational Autoencoder for Designing Random Heteropolymers as Protein Mimics

arXiv cs.LG · yesterday Cached

DeepRHP is a hybrid variational autoencoder that guides the design of random heteropolymers as protein mimics, demonstrated by stabilizing membrane proteins like Aquaporin Z in non-native environments.

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#materials-design

Range-Aware Bayesian Optimization for Discovering Diverse Designs within Target Property Windows

arXiv cs.LG · yesterday Cached

This paper presents a range-aware Bayesian optimization framework that directly scores the posterior probability that a candidate satisfies a target property range, enabling discovery of diverse valid designs across multiple specifications.

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