uta-smile RetroXpert issues

uta-smile / RetroXpert

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RuntimeError: mat1 and mat2 shapes cannot be multiplied (880x598 and 714x128)

#29 LinguaLogician opened 1 month ago
0
graph-level reprentation in papaer didn't match the part in this dode

#26 Honllin opened 1 year ago
0
The model did not achieve the expected effect

#25 jingwang-0415 opened 2 years ago
0
How to use the trained model to predict the custom dataset?

#24 CHANG-Shaole opened 2 years ago
9
How to use trained model form checkpoints?

#23 proevgenii opened 2 years ago
0
SMILES Parse Error

#22 youcefBouraoui opened 2 years ago
0
KeyError: 'pattern_feat' when training the EGAT model

#21 CHANG-Shaole opened 2 years ago
2
Original data

#20 youcefBouraoui closed 2 years ago
0
Checkpoint Question

#19 vthost opened 2 years ago
5
RuntimeError: size mismatch

#18 judory closed 3 years ago
1
Paper Retraction

#17 dixleya closed 3 years ago
1
Input feature channels

#16 gaozhangyang closed 3 years ago
2
Will the information leakage issue affect the performance of the EGAT model?

#15 iamxpy closed 3 years ago
11
Datasets without information leakage.

#14 iamxpy closed 3 years ago
2
Top-k Accuracies

#13 bunnech closed 3 years ago
2
checkpoints for USPTO-full

#12 zhengkaitu closed 3 years ago
5
How to get the accuracy of the second phase?

#11 iamxpy closed 3 years ago
0
one question about the canonicalize_products.py

#10 teslacool closed 3 years ago
5
How to get the accuracy of two phases & any tips to reproduce the results close to those in paper?

#9 iamxpy closed 3 years ago
2
FileNotFoundError: [Errno 2] No such file or directory: '../../experiments/results/predictions_on_USPTO50K-aug-typed_test-prediction.txt'

#8 iamxpy closed 3 years ago
7
How to use canonicalize_products.py

#7 iamxpy closed 3 years ago
7
Need help to train the RGN model

#6 iamxpy closed 3 years ago
9
whats the correct number of semi template patterns?

#5 otori-bird closed 3 years ago
3
setup.sh to set up env

#4 linminhtoo closed 3 years ago
1
Script to generate canonicalized_csv files

#3 linminhtoo closed 3 years ago
2
EGAT train.py error, size mismatch problem

#2 otori-bird closed 3 years ago
7
Any plan to release the source code?

#1 iamxpy closed 3 years ago
0