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Energy Profile Prediction on GEOM-Drugs (test)

0.2454W1 DistanceEGINTERPOLATOR-CASC
-0.2697243.2073636.6844510.161537Apr 5, 2026

Evaluation results

MethodLinks
EGINTERPOLATOR-CASCBlock=12026.040.2454
EGINTERPOLATOR-CASCBlock=22026.040.3654
EGINTERPOLATOR-CASCBlock=32026.040.3656
EGINTERPOLATOR-CASCBlock=42026.040.3702
EGINTERPOLATOR-CASCScope=Overall2026.040.7728
GeoTDMBlock=12026.0411.2398
GeoTDMScope=Overall2026.0412.7664
GeoTDMBlock=22026.0412.8999
GeoTDMBlock=32026.0413.027
GeoTDMBlock=42026.0413.1235