GeminiMol / GeminiMol_crossset_results.csv
AlphaMWang's picture
Upload 7 files
f2fbc88
raw
history blame contribute delete
374 Bytes
,RMSE,PEARSONR,SPEARMANR
ShapeScore,0.030183,0.938465,0.937623
ShapeAggregation,0.026558,0.944433,0.942049
ShapeOverlap,0.025284,0.945429,0.943587
ShapeDistance,0.029228,0.922157,0.921906
CrossSim,0.028545,0.944101,0.943498
CrossAggregation,0.02557,0.947868,0.94566
CrossDist,0.024444,0.938361,0.932552
CrossOverlap,0.023247,0.952244,0.950153
MCS,0.034322,0.972913,0.972038