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igashov
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DiffLinker
DiffLinker: Equivariant 3D-Conditional Diffusion Model for Molecular Linker Design
MIT License
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Can Difflinker do scaffold decoration?
#14
ziyueyang37
opened
6 days ago
0
Larger segments as input
#13
ivandon15
opened
1 month ago
1
Calculating the "Clash Metric" as Described in Your Paper
#12
HShokaku
opened
3 months ago
0
sascorer.py calls removed RDkit module - ModuleNotFoundError: No module named 'rdkit.six'
#11
rsherhod
opened
4 months ago
1
can I run cpu mode to generate linkers?
#10
wenchangzhou-qtx
opened
4 months ago
1
The format of the fragment file
#9
YunyaJiang
opened
11 months ago
0
Question：given the limitation of pocket but without limitataion of --anchors
#8
MachineGUN001
closed
1 year ago
2
cannot repeat the process of fragment generation
#7
MachineGUN001
closed
4 months ago
6
I can't download these models
#6
YunyaJiang
closed
1 year ago
1
Evaluation for reproducing the paper's result
#5
minju-hits
closed
1 year ago
5
Pocket data optimisation
#4
igashov
closed
1 year ago
0
AttributeError: can't set attribute
#3
DimGorr
closed
1 year ago
0
About input fragment file and anchors
#2
dwbaron
closed
1 year ago
2
How to sample with protein backbones??
#1
orgw
closed
1 year ago
2