Mercurial > repos > bgruening > chemfp
comparison nxn_clustering.py @ 8:198b1e30c739 draft
"planemo upload for repository https://github.com/bgruening/galaxytools/tree/master/chemicaltoolbox/chemfp commit e78367b77f2294891914151f642685644d43a5b7"
| author | bgruening |
|---|---|
| date | Tue, 10 Sep 2019 08:16:29 -0400 |
| parents | 0d88631bb7de |
| children | 3b14765c22ee |
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| 7:0d88631bb7de | 8:198b1e30c739 |
|---|---|
| 4 http://code.google.com/p/chem-fingerprints/ | 4 http://code.google.com/p/chem-fingerprints/ |
| 5 Thanks to Andrew Dalke of Andrew Dalke Scientific! | 5 Thanks to Andrew Dalke of Andrew Dalke Scientific! |
| 6 """ | 6 """ |
| 7 import matplotlib | 7 import matplotlib |
| 8 matplotlib.use('Agg') | 8 matplotlib.use('Agg') |
| 9 from matplotlib import rcParams | |
| 10 rcParams.update({'figure.autolayout': True}) | |
| 9 import argparse | 11 import argparse |
| 10 import os | 12 import os |
| 11 import chemfp | 13 import chemfp |
| 12 import scipy.cluster.hierarchy as hcluster | 14 import scipy.cluster.hierarchy as hcluster |
| 13 import pylab | 15 import pylab |