ENTITY
Extended-connectivity fingerprints
Extended-connectivity fingerprints
PulseAugur coverage of Extended-connectivity fingerprints — every cluster mentioning Extended-connectivity fingerprints across labs, papers, and developer communities, ranked by signal.
Total · 30d
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2 over 90d
Releases · 30d
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0 over 90d
Papers · 30d
0
2 over 90d
TIER MIX · 90D
TOPICS
RECENT · PAGE 1/1 · 2 TOTAL
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GraphCliff model improves molecular activity prediction by distinguishing subtle structural differences
Researchers have developed GraphCliff, a novel graph neural network architecture designed to better model critical activity changes in molecules that arise from subtle structural differences. Unlike conventional graph n…
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GNNs enhanced for drug discovery via ECFP pre-training
Researchers have developed a new strategy to enhance Graph Neural Networks (GNNs) for drug discovery tasks like Quantitative Structure-Activity Relationship (QSAR) studies. This method involves pre-training GNNs to pred…