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mwinokan
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BulkDock
💪 BulkDock: Manage batches of Fragmenstein restrained protein-ligand docking jobs
MIT License
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Output statistics file / keep in database?
#10
mwinokan
opened
1 week ago
0
Integrate posebusters / other filtering
#9
mwinokan
opened
1 week ago
0
Add performance estimation to batch placement output
#8
mwinokan
closed
1 week ago
0
Command / batch job to compile job outputs
#7
mwinokan
closed
1 week ago
0
Improve parallel performance
#6
mwinokan
closed
2 weeks ago
2
Split large input files into batches
#5
mwinokan
closed
2 weeks ago
0
Concurrent jobs
#4
mwinokan
closed
2 weeks ago
1
Documentation
#3
mwinokan
opened
1 month ago
0
Ensemble docking
#2
mwinokan
closed
2 weeks ago
1
Spec
#1
mwinokan
opened
1 month ago
1