Files
galaxy/tools/multivariate_stats/pca.py
T

128 lines
3.7 KiB
Python

#!/usr/bin/env python
from galaxy import eggs
import sys, string
from rpy import *
import numpy
def stop_err(msg):
sys.stderr.write(msg)
sys.exit()
infile = sys.argv[1]
x_cols = sys.argv[2].split(',')
method = sys.argv[3]
outfile = sys.argv[4]
outfile2 = sys.argv[5]
if method == 'svd':
scale = center = "FALSE"
if sys.argv[6] == 'both':
scale = center = "TRUE"
elif sys.argv[6] == 'center':
center = "TRUE"
elif sys.argv[6] == 'scale':
scale = "TRUE"
fout = open(outfile,'w')
elems = []
for i, line in enumerate( file ( infile )):
line = line.rstrip('\r\n')
if len( line )>0 and not line.startswith( '#' ):
elems = line.split( '\t' )
break
if i == 30:
break # Hopefully we'll never get here...
if len( elems )<1:
stop_err( "The data in your input dataset is either missing or not formatted properly." )
x_vals = []
for k,col in enumerate(x_cols):
x_cols[k] = int(col)-1
x_vals.append([])
NA = 'NA'
skipped = 0
for ind,line in enumerate( file( infile )):
if line and not line.startswith( '#' ):
try:
fields = line.strip().split("\t")
valid_line = True
for k,col in enumerate(x_cols):
try:
xval = float(fields[col])
except:
skipped += 1
valid_line = False
break
if valid_line:
for k,col in enumerate(x_cols):
xval = float(fields[col])
x_vals[k].append(xval)
except:
skipped += 1
x_vals1 = numpy.asarray(x_vals).transpose()
dat= r.list(array(x_vals1))
set_default_mode(NO_CONVERSION)
try:
if method == "cor":
pc = r.princomp(r.na_exclude(dat), cor = r("TRUE"))
elif method == "cov":
pc = r.princomp(r.na_exclude(dat), cor = r("FALSE"))
elif method=="svd":
pc = r.prcomp(r.na_exclude(dat), center = r(center), scale = r(scale))
except RException, rex:
stop_err("Encountered error while performing PCA on the input data: %s" %(rex))
set_default_mode(BASIC_CONVERSION)
summary = r.summary(pc, loadings="TRUE")
ncomps = len(summary['sdev'])
if type(summary['sdev']) == type({}):
comps = summary['sdev'].keys()
sd = summary['sdev'].values()
for i in range(ncomps):
sd[comps.index('Comp.%s' %(i+1))] = summary['sdev'].values()[i]
elif type(summary['sdev']) == type([]):
comps=[]
for i in range(ncomps):
comps.append('Comp.%s' %(i+1))
sd = summary['sdev']
print >>fout, "#Component\t%s" %("\t".join(["%s" % el for el in range(1,ncomps+1)]))
print >>fout, "#Std. deviation\t%s" %("\t".join(["%.4g" % el for el in sd]))
total_var = 0
vars = []
for s in sd:
var = s*s
total_var += var
vars.append(var)
for i,var in enumerate(vars):
vars[i] = vars[i]/total_var
print >>fout, "#Proportion of variance explained\t%s" %("\t".join(["%.4g" % el for el in vars]))
print >>fout, "#Loadings\t%s" %("\t".join(["%s" % el for el in range(1,ncomps+1)]))
xcolnames = ["c%d" %(el+1) for el in x_cols]
if 'loadings' in summary: #in case of princomp
loadings = 'loadings'
elif 'rotation' in summary: #in case of prcomp
loadings = 'rotation'
for i,val in enumerate(summary[loadings]):
print >>fout, "%s\t%s" %(xcolnames[i], "\t".join(["%.4g" % el for el in val]))
print >>fout, "#Scores\t%s" %("\t".join(["%s" % el for el in range(1,ncomps+1)]))
if 'scores' in summary: #in case of princomp
scores = 'scores'
elif 'x' in summary: #in case of prcomp
scores = 'x'
for obs,sc in enumerate(summary[scores]):
print >>fout, "%s\t%s" %(obs+1, "\t".join(["%.4g" % el for el in sc]))
r.pdf( outfile2, 8, 8 )
r.biplot(pc)
r.dev_off()