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ikmckenz
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adme-pred-py
Python implementation of common ADME properties.
GNU Affero General Public License v3.0
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Python 3.10 compatibility?
#16
Tonylac77
opened
2 months ago
1
boiled_egg_graphical() returns duplicate plots and fails upon re-running
#15
fernan
closed
6 months ago
1
Pylint changes
#14
ikmckenz
closed
2 years ago
0
Improve PyLint Compliance and tune config
#13
ikmckenz
closed
2 years ago
0
Add basic testing
#12
ikmckenz
opened
3 years ago
0
Create test_file_001.txt, testing fork and license agreements.
#11
BadAssBlueRhino
closed
4 years ago
2
Change main run function to accept input from terminal
#10
ikmckenz
opened
4 years ago
1
Make a reasonable "full report" function
#9
ikmckenz
closed
4 years ago
0
Add Cytochrome P450 inhibition ML model
#8
ikmckenz
opened
4 years ago
10
Add Brenk and PAINS MedChem filters
#7
ikmckenz
closed
4 years ago
1
Add Martin 'A Bioavailability Score'
#6
ikmckenz
opened
4 years ago
3
Add boolean returning BOILED-Egg druglikeness filters
#5
ikmckenz
closed
4 years ago
1
Add Muegge druglikeness filter
#4
ikmckenz
closed
4 years ago
1
Add Egan druglikeness filter
#3
ikmckenz
closed
4 years ago
1
Add Veber druglikeness filter
#2
ikmckenz
closed
4 years ago
1
Add Ghose druglikeness filter
#1
ikmckenz
closed
4 years ago
1