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maltefranke
/
morph
Like
1
PyTorch
chemistry
molecular-generation
scaffold-decoration
flow-matching
qm9
geom-drugs
chembl3d
crossdocked
structure-based-drug-design
3d
arxiv:
2606.07239
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main
morph
/
chembl3d
/
implicit_h
/
runtime
/
configs
39.5 kB
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1 commit
maltefranke
Add ChEMBL3D explicit-H epochs 200/300/400 and implicit-H epochs 100/200/300 with inference bundles
ab9bea9
verified
14 days ago
callbacks
Add ChEMBL3D explicit-H epochs 200/300/400 and implicit-H epochs 100/200/300 with inference bundles
14 days ago
data
Add ChEMBL3D explicit-H epochs 200/300/400 and implicit-H epochs 100/200/300 with inference bundles
14 days ago
defaults
Add ChEMBL3D explicit-H epochs 200/300/400 and implicit-H epochs 100/200/300 with inference bundles
14 days ago
embeddings
Add ChEMBL3D explicit-H epochs 200/300/400 and implicit-H epochs 100/200/300 with inference bundles
14 days ago
heads
Add ChEMBL3D explicit-H epochs 200/300/400 and implicit-H epochs 100/200/300 with inference bundles
14 days ago
insertion_head
Add ChEMBL3D explicit-H epochs 200/300/400 and implicit-H epochs 100/200/300 with inference bundles
14 days ago
integrator
Add ChEMBL3D explicit-H epochs 200/300/400 and implicit-H epochs 100/200/300 with inference bundles
14 days ago
logging
Add ChEMBL3D explicit-H epochs 200/300/400 and implicit-H epochs 100/200/300 with inference bundles
14 days ago
loss_weights
Add ChEMBL3D explicit-H epochs 200/300/400 and implicit-H epochs 100/200/300 with inference bundles
14 days ago
model
Add ChEMBL3D explicit-H epochs 200/300/400 and implicit-H epochs 100/200/300 with inference bundles
14 days ago
optimizer
Add ChEMBL3D explicit-H epochs 200/300/400 and implicit-H epochs 100/200/300 with inference bundles
14 days ago
schedule
Add ChEMBL3D explicit-H epochs 200/300/400 and implicit-H epochs 100/200/300 with inference bundles
14 days ago
trainer
Add ChEMBL3D explicit-H epochs 200/300/400 and implicit-H epochs 100/200/300 with inference bundles
14 days ago
default.yaml
1.29 kB
Add ChEMBL3D explicit-H epochs 200/300/400 and implicit-H epochs 100/200/300 with inference bundles
14 days ago