diff --git "a/UMA-small_ext/folding_stability/result.json" "b/UMA-small_ext/folding_stability/result.json" --- "a/UMA-small_ext/folding_stability/result.json" +++ "b/UMA-small_ext/folding_stability/result.json" @@ -1,12074 +1,374 @@ { - "score": 0.5271214010679641, + "score": 0.5286821852023141, "molecules": [ { "structure_name": "chignolin_1uao_xray", "rmsd_trajectory": [ 4.712160915387242e-08, - 0.02292772191948785, - 0.024319767552158884, - 0.02496926025881835, - 0.02542864128295552, - 0.0288423792868263, - 0.03476745378163732, - 0.028323597921593162, - 0.027438265893127617, - 0.029442163656033755, - 0.031619312173961675, - 0.035598367064277575, - 0.04392556199135415, - 0.054302996173643744, - 0.05445469131831099, - 0.03658183196445346, - 0.035553001386083374, - 0.034818378692748404, - 0.041518652624639364, - 0.04961614572693283, - 0.047720859705079624, - 0.04207678293176791, - 0.04376075532360907, - 0.045533136901343044, - 0.04507734582210738, - 0.04717370443221168, - 0.04485500733094389, - 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