ENTITY
Neural network potentials
Neural network potentials
PulseAugur coverage of Neural network potentials — every cluster mentioning Neural network potentials 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
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2 over 90d
TIER MIX · 90D
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RECENT · PAGE 1/1 · 2 TOTAL
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AdaptNTK framework enhances AI for molecular dynamics simulations
Researchers have developed AdaptNTK, a novel framework for quantifying uncertainty and implementing active learning in neural network potentials. This single-model approach uses a regularized Mahalanobis distance in emp…
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New framework speeds up neural network training for enzyme catalysis
Researchers have developed Enerzyme, a new framework designed to make training neural network potentials (NNPs) more efficient for studying enzyme catalysis. This framework addresses the computational demands of quantum…