Results 291 to 300 of about 1,140,283 (405)

Free‐space Optical Computing Systems

open access: yesAnnalen der Physik, EarlyView.
Manipulation and propagation of optical wavefronts in free space enables new intelligent computing hardware. Two types of optical computing systems, matrix and vector multiplication systems and diffractive optical neural network systems, are reviewed from material, device, and system aspects.
Ruiyang Chen, Weilu Gao
wiley   +1 more source

Mitigating Molecular Aggregation in Drug Discovery with Predictive Insights from Explainable AI

open access: yesAngewandte Chemie International Edition, Accepted Article.
Herein, we present the application of MEGAN, our explainable AI (xAI) model, for the identification of small colloidally aggregating molecules (SCAMs). This work offers solutions to the long‐standing problem of false positives caused by SCAMs in high throughput screening for drug discovery and demonstrates the power of xAI in the classification of ...
Hunter Sturm   +4 more
wiley   +1 more source

Redirecting the Peptide Cleavage Causes Protease Inactivation

open access: yesAngewandte Chemie International Edition, Accepted Article.
Cysteine and serine proteases cleave peptides through covalent catalysis by generating a transient adduct with the N‐terminal part of the substrate after releasing its C‐terminal part. We demonstrate the unique redirection of this event leading to strong enzyme inactivation.
Michael Gütschow   +20 more
wiley   +1 more source

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