Pre-training via Denoising for Molecular Property Prediction.
Sheheryar ZaidiMichael SchaarschmidtJames MartensHyunjik KimYee Whye TehAlvaro Sanchez-GonzalezPeter W. BattagliaRazvan PascanuJonathan GodwinPublished in: ICLR (2023)
Keyphrases
- denoising
- image denoising
- drug design
- training process
- training algorithm
- image processing
- training samples
- noisy images
- prediction accuracy
- radial basis function network
- prediction error
- three dimensional
- training phase
- prediction model
- total variation
- gaussian noise
- noise removal
- drug discovery
- support vector
- protein function prediction