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Energy and Force Prediction on QM7-X full (unknown molecules / unknown conformations)

13.151Energy MAESPOOKYNET
11.6260421.9195232.21342.50648May 28, 2022

Evaluation results

MethodLinks
SPOOKYNET2022.0513.15117.326
PAINN2022.0517.59424.161
SO3KRATESNon-local correction=true2022.0520.07124.236
SO3KRATESFeature dimension (F)=1322022.0521.73325.211
SO3KRATESFeature dimension (F)=2642022.0521.7523.169
SCHNET2022.0551.27562.77