GPS++: An Optimised Hybrid MPNN/Transformer for Molecular Property Prediction.
Dominic MastersJosef DeanKerstin KlaserZhiyi LiSam Maddrell-ManderAdam SandersHatem HelalDeniz BekerLadislav RampásekDominique BeainiPublished in: CoRR (2022)
Keyphrases
- prediction accuracy
- fuzzy logic
- prediction model
- three dimensional
- fault diagnosis
- drug design
- protein structure prediction
- data sets
- mobile devices
- protein function prediction
- location based services
- prediction algorithm
- adaptive kalman filter
- van der waals
- gps data
- hybrid learning
- prediction error
- regression model
- expert systems