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wenhao-gao
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SynNet
MIT License
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Decoder appears to decode random initial fingerprints to the same SMILES
#22
andreirekesh
opened
3 months ago
0
No output in Synthesis Planning
#21
sjchasel
closed
1 year ago
0
index 192158 is out of bounds for axis 0 with size 179821
#20
JackAILab
opened
1 year ago
0
WIP: Syntree visualisation with graphviz
#19
chrulm
closed
1 year ago
0
Complete synthesis and optimization notebooks
#18
GabrielFleischer
closed
1 year ago
1
Refactor SynNet
#17
chrulm
closed
2 years ago
0
fix: add positional arg
#16
chrulm
closed
2 years ago
0
Bug: Missing argument `_tree`
#15
chrulm
closed
2 years ago
0
add docs on `compute_embedding.py` needed for inference
#14
linminhtoo
closed
2 years ago
2
ZINC csv used by publication
#13
linminhtoo
closed
2 years ago
1
hardcoded paths in training `validation_step`
#12
linminhtoo
closed
2 years ago
1
predict_multireactant_mp.py error
#11
SejeongPark8354
closed
2 years ago
1
Bug/tests paths
#10
degraff-roivant
closed
2 years ago
0
No mol_fp module in _mp_decode.py
#9
SejeongPark8354
closed
2 years ago
2
Running optimize_ga.py
#8
tkram01
closed
2 years ago
3
poll ->_pool and crossover->offspring_crossover
#7
tkram01
closed
2 years ago
0
Issue running optimize_ga.py
#6
tkram01
closed
2 years ago
0
gin_embedding->model
#5
tkram01
closed
2 years ago
1
Error computing embeddings
#4
tkram01
closed
2 years ago
1
Errors in creating env and running unit tests.
#3
geemi725
closed
2 years ago
2
Can't locate env/synthenv.yml
#2
yipy0005
closed
2 years ago
1
Unit Test Files
#1
lilleswing
closed
3 years ago
4