Modulating the localized electronic distribution of Cu species during reconstruction for enhanced electrochemical CO2 reduction to C2+ products
Sign Up to like & getrecommendations! Published in 2024 at "Journal of Materials Chemistry A"
DOI: 10.1039/d4ta01184h
Abstract: Electrochemical conversion of carbon dioxide (CO2RR) into high-value multi-carbon (C2+) chemicals and fuels is of great significance for carbon neutrality, and so far the Cu-based materials are still the dominant... read more here.
Keywords: localized electronic; modulating localized; reconstruction enhanced; distribution species ... See more keywords
R2eGIN: Residual Reconstruction Enhanced Graph Isomorphism Network for Accurate Prediction of Poly (ADP–Ribose) Polymerase Inhibitors
Sign Up to like & getrecommendations! Published in 2025 at "Bioinformatics and Biology Insights"
DOI: 10.1177/11779322251366087
Abstract: An advanced graph neural network (GNN) is of great promise to facilitate predicting Poly ADPribose polymerase inhibitors (PARPi). Recent studies design models by leveraging graph representations and molecular descriptor representations, unfortunately, still face challenges in… read more here.
Keywords: residual reconstruction; enhanced graph; reconstruction enhanced; graph isomorphism ... See more keywords