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Accelerating materials discovery using artificial intelligence, high performance computing and robotics
New tools enable new ways of working, and materials science is no exception. In materials
discovery, traditional manual, serial, and human-intensive work is being augmented by …
discovery, traditional manual, serial, and human-intensive work is being augmented by …
Weakly supervised machine learning
Supervised learning aims to build a function or model that seeks as many map**s as
possible between the training data and outputs, where each training data will predict as a …
possible between the training data and outputs, where each training data will predict as a …
Deep learning in protein structural modeling and design
Deep learning is catalyzing a scientific revolution fueled by big data, accessible toolkits, and
powerful computational resources, impacting many fields, including protein structural …
powerful computational resources, impacting many fields, including protein structural …
Advances in machine learning for directed evolution
Machine learning (ML) can expedite directed evolution by allowing researchers to move
expensive experimental screens in silico. Gathering sequence-function data for training ML …
expensive experimental screens in silico. Gathering sequence-function data for training ML …
Perfection not required? Human-AI partnerships in code translation
Generative models have become adept at producing artifacts such as images, videos, and
prose at human-like levels of proficiency. New generative techniques, such as unsupervised …
prose at human-like levels of proficiency. New generative techniques, such as unsupervised …
Generating functional protein variants with variational autoencoders
The vast expansion of protein sequence databases provides an opportunity for new protein
design approaches which seek to learn the sequence-function relationship directly from …
design approaches which seek to learn the sequence-function relationship directly from …
[HTML][HTML] Protein–protein interaction prediction with deep learning: A comprehensive review
Most proteins perform their biological function by interacting with themselves or other
molecules. Thus, one may obtain biological insights into protein functions, disease …
molecules. Thus, one may obtain biological insights into protein functions, disease …
A foundation model identifies broad-Spectrum antimicrobial peptides against drug-resistant bacterial infection
Abstract Development of potent and broad-spectrum antimicrobial peptides (AMPs) could
help overcome the antimicrobial resistance crisis. We develop a peptide language-based …
help overcome the antimicrobial resistance crisis. We develop a peptide language-based …
Recent progress in the discovery and design of antimicrobial peptides using traditional machine learning and deep learning
Antimicrobial resistance has become a critical global health problem due to the abuse of
conventional antibiotics and the rise of multi-drug-resistant microbes. Antimicrobial peptides …
conventional antibiotics and the rise of multi-drug-resistant microbes. Antimicrobial peptides …
Artificial intelligence in early drug discovery enabling precision medicine
Introduction: Precision medicine is the concept of treating diseases based on environmental
factors, lifestyles, and molecular profiles of patients. This approach has been found to …
factors, lifestyles, and molecular profiles of patients. This approach has been found to …