Volume 4 Issue 6, June 2022

Unsupervised machine learning algorithms reduce the dependence on curated, labeled datasets that are characteristic of supervised machine learning. The authors argue that the developmental science of infant cognition could inform the design of unsupervised machine learning approaches.

Both proteins and natural language are essentially based on a sequential code, but feature complex interactions at multiple scales, which can be useful when transferring machine learning models from one domain to another. In this Review, Ferruz and Höcker summarize recent advances in language models, such as transformers, and their application to protein design.

Robots usually learn to use tools from direct experience or from observing the use of a tool. While knowledge can be transferred between similar tools, novel and creative use of tools is challenging. Tee and colleagues present a method where skill transfer does not come from experience of using other tools but from using the robot’s own limbs.

A variational autoencoder is trained on a dataset of quantum optics experiment configurations and learns an interpretable representation of the relationship between experiment setup and quantum entanglement. The approach can be used to explore new experiment designs with specific, highly entangled states.

While reinforcement learning can be a powerful tool for complex design tasks such as molecular design, training can be slow when problems are either too hard or too easy, as little is learned in these cases. Jeff Guo and colleagues provide a curriculum learning extension to the REINVENT de novo molecular design framework that provides problems of increasing difficulty over epochs such that the training process is more efficient.

Neural networks in the brain often exhibit chaotic dynamics that can be captured by a small number of dimensions. Farrell et al. find that recurrent neural networks trained with gradient-based learning rules exhibit similar features. This helps form robust but generalizable input representations.

Exoskeletons can assist movement in upper limb impairments to recover mobility and independence, but rigid or heavy exoskeletons can be impractical. Georgarakis and colleagues have developed a soft, tendon-driven device that assists shoulder movements and counteracts gravity to reduce muscle fatigue.

Fluorescent markers in microscopy-based drug screens carry information on how compounds affect biological processes, but practical considerations may hinder their use. Wong et al. develop a deep learning method for generating images in drug discovery, with broad applicability across diverse fluorescence microscopy datasets.

B-cell receptors (BCRs) and their impact on B cells play a vital role in our immune system; however, the manner in which B cells are activated by BCRs are still poorly understood. Ze Zhang and colleagues present a graph-based method that connects BCR and single B-cell RNA sequencing data and identifies notable coupling between BCR and B-cell expression in COVID-19.