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dataprofessor
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beta-lactamase
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comparison of graph2vec vs fingerprint representation in RF model
#9
prabinrs
opened
2 years ago
0
Added the analysis IPYNB file under a new folder IPYNB from Anindya branch
#8
Anindyadeep
closed
1 year ago
0
Similarity based virtual screening of beta lactamase inhibitors
#7
sattiannusri
opened
2 years ago
0
Testing
#6
JenetteH-Projects
opened
3 years ago
0
Create Activity Cliffs Plot for the beta-lactamase database
#5
rflameiro
opened
3 years ago
0
Update the README, add jupyter notebook with EDA, fingerprint calculations, and binary calssifiers, and include fingerprint data
#4
sayalaruano
closed
1 year ago
0
Number of PubChem molecular descriptors problem.
#3
semsem80
opened
3 years ago
0
Number of molecular descriptors obtained with PaDEL differs from the number of molecules in the molecule.smi file
#2
sayalaruano
opened
3 years ago
7
Updated the Readme and added a notebook generating a new dataset
#1
wguesdon
opened
3 years ago
1