OpenCodePapers

graph-regression-on-lipophilicity

Graph Regression
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PaperCodeRMSER2RMSE@80%TrainModelNameReleaseDate
Principal Neighbourhood Aggregation for Graph Nets✓ Link0.520±0.0110.830±0.007PNA2020-04-12
How Attentive are Graph Attention Networks?✓ Link0.534±0.0140.821±0.009GATv22021-05-30
Graph Attention Networks✓ Link0.536±0.0200.820±0.014GAT2017-10-30
How Powerful are Graph Neural Networks?✓ Link0.537±0.0100.819±0.007GIN2018-10-01
An end-to-end attention-based approach for learning on graphs✓ Link0.552±0.0120.809±0.008ESA (Edge set attention, no positional encodings)2024-02-16
DropGNN: Random Dropouts Increase the Expressiveness of Graph Neural Networks✓ Link0.552±0.0120.809±0.008DropGIN2021-11-11
Semi-Supervised Classification with Graph Convolutional Networks✓ Link0.565±0.0110.800±0.008GCN2016-09-09
Recipe for a General, Powerful, Scalable Graph Transformer✓ Link0.579±0.0060.790±0.004GraphGPS2022-05-25
Optimal Transport Graph Neural Networks✓ Link0.580ProtoS-L22020-06-08
Molecule Property Prediction Based on Spatial Graph Embedding✓ Link0.650C-SGEN+ Fingerprint2019-08-22
Convolutional Networks on Graphs for Learning Molecular Fingerprints✓ Link0.655GC2015-09-30
Molecular Graph Convolutions: Moving Beyond Fingerprints✓ Link0.715Weave2016-03-02
Neural Message Passing for Quantum Chemistry✓ Link0.719MPNN2017-04-04
Do Transformers Really Perform Bad for Graph Representation?✓ Link0.791±0.0480.607±0.048Graphormer2021-06-09
Molecular Property Prediction: A Multilevel Quantum Interactions Modeling Perspective✓ Link0.799XGBoost2019-06-25
Pure Transformers are Powerful Graph Learners✓ Link0.852±0.0230.545±0.024TokenGT2022-07-06
Molecular Property Prediction: A Multilevel Quantum Interactions Modeling Perspective✓ Link0.876RF2019-06-25
Graph Neural Networks with convolutional ARMA filters✓ Link0.894ARMA2019-01-05
Attention-based Graph Neural Network for Semi-supervised Learning✓ Link0.963AGNN2018-03-10
Simplifying Graph Convolutional Networks✓ Link0.998SGC2019-02-19
CensNet: Convolution with Edge-Node Switching in Graph Neural Networks0.93CensNet2019-08-10
CensNet: Convolution with Edge-Node Switching in Graph Neural Networks1.15Logistic Regression2019-08-10
CensNet: Convolution with Edge-Node Switching in Graph Neural Networks1.16Random Forests2019-08-10