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TravisWheelerLab
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drug-sniffer
Sniffing out new drugs
http://drugsniffer.org
BSD 3-Clause "New" or "Revised" License
21
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9
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Development and maintenance pause
#16
traviswheeler
opened
1 year ago
4
Intial batch setup.
#15
laurenfitch
closed
1 year ago
1
AWS Batch error
#14
laurenfitch
opened
1 year ago
8
Split small molecule database by vendor
#13
traviswheeler
closed
1 year ago
1
Parallelize similarity search (stage 4)
#12
glesica
opened
2 years ago
0
Upgrade fpadmet
#11
glesica
opened
2 years ago
0
Upgrade to the latest autodock vina
#10
glesica
opened
2 years ago
0
Supply a workflow and documentation for training a new model
#9
glesica
opened
2 years ago
0
Automate image building through GitHub
#8
glesica
opened
2 years ago
0
Add a SLURM tutorial
#7
glesica
opened
2 years ago
0
Support Singularity containers
#6
glesica
opened
2 years ago
0
Add report option
#5
glesica
opened
2 years ago
0
Allow users to set minimum CPUs for stages
#4
glesica
opened
2 years ago
0
Add additional Nextflow information to the docs
#3
glesica
opened
2 years ago
0
Split feature creation from the dock2bind model stage
#2
glesica
opened
2 years ago
0
Update README.md
#1
AmitavaRoylab
closed
2 years ago
0