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train
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train
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0.286475
train
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0.356645
train
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0.429698
train
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train
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train
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0.433177
train
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0.392607
train
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train
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train
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0.207753
train
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train
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train
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train
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train
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train
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0.68699
train
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train
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train
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train
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train
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train
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train
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train
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train
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train
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train
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0.711267
train
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train
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train
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train
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train
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train
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train
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train

Description

Thermostability prediction is a regression task where each input protein x is mapped to a label yR, corresponding to the thermostability of x.

Splits

Structure type: AF2

The dataset is from FLIP: Benchmark tasks in fitness landscape inferencefor proteins. We employ all proteins from the“Human-cell”splits (proteins that lack AF2 structures are removed), and split them based on 70% structure similarity (see ProteinShake), with the number of training, validation and test set shown below:

  • Train: 5310
  • Valid: 706
  • Test: 706

Label

This label indicates the normalized thermostability of the protein, ranging from 0 to 1 (through min–max normalization). The original label ranges from 40 to 67.

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