def getBestVolumes(log,WorkingDir,NRansac,NumVolumes,UseAll):
volumes = []
inliers = []
for n in range(NRansac):
fnAngles = os.path.join(WorkingDir,"tmp/angles_ransac%05d"%n+".xmd")
md=MetaData("inliers@"+fnAngles)
numInliers=md.getValue(MDL_WEIGHT,md.firstObject())
volumes.append(fnAngles)
inliers.append(numInliers)
index = sorted(range(inliers.__len__()), key=lambda k: inliers[k])
fnBestAngles = ''
threshold=getCCThreshold(WorkingDir)
i=NRansac-1
indx = 0
while i>=0 and indx<NumVolumes:
fnBestAngles = volumes[index[i]]
fnBestAnglesOut=os.path.join(WorkingDir,"volumeProposed%05d"%indx+".xmd")
copyFile(log,fnBestAngles,fnBestAnglesOut)
print("Best volume "+str(indx)+" = "+fnBestAngles)
if not UseAll:
runJob(log,"xmipp_metadata_utilities","-i %s -o %s --query select \"maxCC>%f \" --mode append" %(fnBestAnglesOut,fnBestAnglesOut,threshold))
if getMdSize(fnBestAnglesOut) > 0:
indx += 1
else:
indx += 1
i -= 1
# Remove unnecessary files
for n in range(NRansac):
fnAngles = os.path.join(WorkingDir,"tmp/angles_ransac%05d"%n+".xmd")
deleteFile(log, fnAngles)
def exportReliontoMetadataFile(inputRelion,outputXmipp):
""" This function will receive a relion file and will
convert to the one xmipp metadata file.
"""
if str2Label('rlnImageName')== -1:
addRelionLabels()
#add xmipp header
line1="""# XMIPP_STAR_1 *
#
"""
tmpFile = inputRelion + '.tmp'
fOut = open(tmpFile,'w')
fOut.write(line1)
#copy and paste relion file
fIn = open(inputRelion,'r')
fOut.write(fIn.read())
fOut.flush()
fOut.close()
#addRelionLabels MUST BE CALLED FROM CODE
blocklist = getBlocksInMetaDataFile(tmpFile)
if exists (outputXmipp):
os.remove(outputXmipp)
for block in blocklist:
md = MetaData(block + '@'+tmpFile)
if len(md.getActiveLabels())!=0:
md.write(block +'@'+ outputXmipp,MD_APPEND)
from protlib_filesystem import deleteFile
deleteFile(None, tmpFile,False)
def _visualizeDisplayReconstruction(self):
""" Visualize selected volumes per iterations.
If show in slices, create a temporal single metadata
for avoid opening multiple windows.
"""
prefixes = self._getPrefixes()
if self._visualizeVolumesMode == 'slices':
fn = self.getFilename('selected_volumes')
if xmippExists(fn):
deleteFile(None, fn)
for it in self._visualizeIterations:
volMd = MetaData()
for prefix in prefixes:
for ref3d in self._visualizeRef3Ds:
volFn = self.getFilename('%svolume' % prefix, iter=it, ref3d=ref3d)
volMd.setValue(MDL_IMAGE, volFn, volMd.addObject())
block = 'volumes_iter%06d@' % it
volMd.write(block + fn, MD_APPEND)
self.display2D(fn)
else:
for it in self._visualizeIterations:
for prefix in prefixes:
for ref3d in self._visualizeRef3Ds:
self.display3D(self.getFilename('%svolume' % prefix, iter=it, ref3d=ref3d))
def reconstructClass(
log,
WorkingDir,
ExtraDir,
ClassNameIn,
ClassNameOut,
ClassImage,
CenterMaxShift,
ThinObject,
SkipTiltedTranslations,
ClassVolumeOut,
ReconstructAdditionalParams,
DoLowPassFilter,
LowPassFilter,
):
# If class image doesn't exists, generate it by averaging
if len(ClassImage) == 0:
classRootOut = ClassNameOut.replace(".xmd", "") + "_"
params = "-i %(ClassNameIn)s --save_image_stats %(classRootOut)s -o %(ExtraDir)s/stats.xmd" % locals()
runJob(log, "xmipp_image_statistics", params)
ClassImage = classRootOut + "average.xmp"
deleteFile(log, classRootOut + "stddev.xmp")
deleteFile(log, "%(ExtraDir)s/stats.xmd" % locals())
params = "-i %(ClassNameIn)s -o %(ClassNameOut)s --ref %(ClassImage)s --max_shift %(CenterMaxShift)d" % locals()
if ThinObject:
params += " --do_stretch"
if SkipTiltedTranslations:
params += " --do_not_align_tilted"
runJob(log, "xmipp_image_align_tilt_pairs", params)
params = "-i %(ClassNameOut)s -o %(ClassVolumeOut)s %(ReconstructAdditionalParams)s" % locals()
runJob(log, "xmipp_reconstruct_art", params)
if exists(ClassVolumeOut):
mdFn = join(WorkingDir, "volumes.xmd")
md = MetaData()
if exists(mdFn):
md.read(mdFn)
objId = md.addObject()
md.setValue(MDL_IMAGE, ClassVolumeOut, objId)
if DoLowPassFilter:
filteredVolume = ClassVolumeOut.replace(".vol", "_filtered.vol")
params = "-i %(ClassVolumeOut)s -o %(filteredVolume)s --fourier low_pass %(LowPassFilter)f" % locals()
runJob(log, "xmipp_transform_filter", params)
objId = md.addObject()
md.setValue(MDL_IMAGE, filteredVolume, objId)
md.write(mdFn)
def automaticRejection(log,WorkingDir,condition,MDL_TYPE):
fnMic=os.path.join(WorkingDir,"micrographs.xmd")
fnRejected=os.path.join(WorkingDir,"tmp/rejectedMicrographs.xmd")
runJob(log,"xmipp_metadata_utilities",'-i %s --query select "%s" -o %s'%(fnMic,condition,fnRejected))
md = xmipp.MetaData(fnRejected)
fnRejectedMicrographs=md.getColumnValues(MDL_TYPE)
md.read(fnMic)
for id in md:
fnCurrentMicrograph=md.getValue(MDL_TYPE,id)
if fnCurrentMicrograph in fnRejectedMicrographs:
md.setValue(xmipp.MDL_ENABLED,-1,id)
md.write(fnMic)
deleteFile(log,fnRejected)
def sortClasses(log,ExtraDir,Nproc,suffix):
if Nproc==1:
Nproc=2
if Nproc>8:
Nproc=8
for filename in glob.glob(os.path.join(ExtraDir,"level_??/level_classes%s.xmd"%suffix)):
level=int(re.search('level_(\d\d)',filename).group(1))
fnRoot=os.path.join(ExtraDir,"level_%02d/level_classes%s_sorted"%(level,suffix))
params= "-i classes@"+filename+" --oroot "+fnRoot
runJob(log,"xmipp_image_sort",params,Nproc)
mD=MetaData(fnRoot+".xmd")
mD.write("classes_sorted@"+filename,MD_APPEND)
deleteFile(log,fnRoot+".xmd")
def findDihedrical(log,WorkingDir,InputVolume,CylinderRadius):
fnRotated=os.path.join(WorkingDir,'tmp','volume_rotated.vol')
runJob(log,"xmipp_transform_geometry","-i %s -o %s --rotate_volume axis 180 1 0 0"%(InputVolume,fnRotated))
if CylinderRadius>0:
[xdim,ydim,zdim,ndim]=getImageSize(InputVolume)
maskArgs=" --mask cylinder %d %d"%(int(-CylinderRadius),int(-xdim))
else:
maskArgs=""
runJob(log,"xmipp_volume_align","--i1 %s --i2 %s --rot 0 360 3 -z -2 2 0.5 --apply"%(InputVolume,fnRotated)+maskArgs)
runJob(log,"xmipp_volume_align","--i1 %s --i2 %s --local --apply"%(InputVolume,fnRotated)+maskArgs)
runJob(log,"xmipp_image_operate","-i %s --plus %s -o %s"%(InputVolume,fnRotated,InputVolume))
runJob(log,"xmipp_image_operate","-i %s --divide 2"%(InputVolume))
runJob(log,"xmipp_transform_mask","-i %s "%(InputVolume)+maskArgs)
deleteFile(log,fnRotated)
def qualifyModes(log,WorkingDir,NumberOfModes,StructureType,CollectivityThreshold):
currentDir=os.getcwd()
changeDir(log,WorkingDir)
fnVec=glob.glob("modes/vec.*")
if len(fnVec)<NumberOfModes:
fhWarning=open("warnings.xmd",'w')
fhWarning.write(redStr("There are only "+str(len(fnVec))+" modes instead of "+str(NumberOfModes)+". Check the number of modes you asked to compute and/or consider increasing cut-off distance. The maximum number of modes allowed by the method for atomic normal mode analysis is 6 times the number of RTB blocks and for pseudoatomic normal mode analysis 3 times the number of pseudoatoms. However, the protocol allows only up to 200 modes as 20-100 modes are usually enough. If the number of modes is below the minimum between these two numbers, consider increasing cut-off distance.")+"\n")
fhWarning.close()
fnDiag="diagrtb.eigenfacs"
if StructureType=="EM":
runJob(log,"nma_reformatForElNemo.sh","%d"%NumberOfModes)
fnDiag="diag_arpack.eigenfacs"
runJob(log,"echo","%s | nma_check_modes"%fnDiag)
deleteFile(log,fnDiag)
fh=open("Chkmod.res")
MDout=MetaData()
collectivityList=[]
for n in range(NumberOfModes):
line=fh.readline()
collectivity=float(line.split()[1])
collectivityList.append(collectivity)
id=MDout.addObject()
MDout.setValue(MDL_NMA_MODEFILE,os.path.join(WorkingDir,"modes/vec.%d"%(n+1)),id)
MDout.setValue(MDL_ORDER,long(n+1),id)
if n>=6:
MDout.setValue(MDL_ENABLED,1,id)
else:
MDout.setValue(MDL_ENABLED,-1,id)
MDout.setValue(MDL_NMA_COLLECTIVITY,collectivity,id)
if collectivity<CollectivityThreshold:
MDout.setValue(MDL_ENABLED,-1,id)
fh.close()
idxSorted=[i[0] for i in sorted(enumerate(collectivityList), key=lambda x:x[1])]
score=[0]*NumberOfModes
for i in range(NumberOfModes):
score[i]+=i+1
score[idxSorted[i]]+=NumberOfModes-i
i=0
for id in MDout:
score_i=float(score[i])/(2.0*NumberOfModes)
MDout.setValue(MDL_NMA_SCORE,score_i,id)
i+=1
MDout.write("modes.xmd")
deleteFile(log,"Chkmod.res")
changeDir(log,currentDir)
def ransacIteration(log,WorkingDir,n,fnClasses,SymmetryGroup,Xdim,Xdim2,NumSamples,InitialVolume,AngularSampling):
fnBase="ransac%05d"%n
TmpDir=os.path.join(WorkingDir,"tmp")
fnRoot=os.path.join(TmpDir,fnBase)
runJob(log,"xmipp_metadata_utilities","-i %s -o %s.xmd --operate random_subset %d --mode overwrite "%(fnClasses,fnRoot,NumSamples))
runJob(log,"xmipp_metadata_utilities","-i %s.xmd --fill angleRot rand_uniform -180 180 "%(fnRoot))
runJob(log,"xmipp_metadata_utilities","-i %s.xmd --fill angleTilt rand_uniform 0 180 "%(fnRoot))
runJob(log,"xmipp_metadata_utilities","-i %s.xmd --fill anglePsi rand_uniform 0 360 "%(fnRoot))
# If there is an initial volume, assign angles
if (InitialVolume != ''):
fnGallery=os.path.join(TmpDir,'gallery_InitialVolume.stk')
runJob(log,"xmipp_angular_projection_matching", "-i %s.xmd -o %s.xmd --ref %s --Ri 0 --Ro %s --max_shift %s --append -v 0"\
%(fnRoot,fnRoot,fnGallery,str(Xdim/2),str(Xdim/20)))
# Reconstruct with the small sample
reconstruct(log,fnRoot,SymmetryGroup,Xdim2/2)
fnVol = fnRoot+'.vol'
# Generate projections from this reconstruction
fnGallery=os.path.join(TmpDir,'gallery_'+fnBase+'.stk')
runJob(log,"xmipp_angular_project_library", "-i %s -o %s --sampling_rate %f --sym %s --method fourier 1 0.25 bspline --compute_neighbors --angular_distance -1 --experimental_images %s -v 0"\
%(fnVol,fnGallery,float(AngularSampling),SymmetryGroup,fnClasses))
# Assign angles to the rest of images
fnAngles=os.path.join(TmpDir,'angles_'+fnBase+'.xmd')
runJob(log,"xmipp_angular_projection_matching", "-i %s -o %s --ref %s --Ri 0 --Ro %s --max_shift %s --append -v 0"\
%(fnClasses,fnAngles,fnGallery,str(Xdim/2),str(Xdim/20)))
# Delete intermediate files
deleteFile(log,fnGallery)
deleteFile(log,os.path.join(TmpDir,'gallery_'+fnBase+'_sampling.xmd'))
deleteFile(log,os.path.join(TmpDir,'gallery_'+fnBase+'.doc'))
deleteFile(log,fnVol)
deleteFile(log,os.path.join(TmpDir,fnBase+'.xmd'))
def exportMdToRelion(md, outputRelion):
""" This function will receive a Xmipp metadata and will
convert to the one expected by Relion.
All labels not recognized by Relion will be dropped.
Params:
md: input xmipp metadata.
outputRelion: output filename to store the Relion star file.
"""
for label in md.getActiveLabels():
if not label in XMIPP_RELION_LABELS:
md.removeLabel(label)
tmpFile = outputRelion + '.tmp'
md.write(tmpFile)
# Create a dict with the names
d = {}
for k, v in XMIPP_RELION_LABELS.iteritems():
d[label2Str(k)] = v
#print "dict: ", d
renameMdLabels(tmpFile, outputRelion, d)
from protlib_filesystem import deleteFile
deleteFile(None, tmpFile)
def extendCore(log,WorkingDirStructureCore,WorkingDirStructureExtended,NumVolumes,RemainingClasses,ComplementaryClasses,AngularSampling,\
SymmetryGroup,CorrThresh,NumberOfMpi):
from protlib_projmatch import projMatch
fnCore=os.path.join(WorkingDirStructureCore,"imagesCore.xmd")
fnComplementary=os.path.join(WorkingDirStructureExtended,"imagesComplementary.xmd")
runJob(log,"xmipp_metadata_utilities","-i %s --set subtraction %s image image -o %s"%(RemainingClasses,fnCore,fnComplementary))
runJob(log,"xmipp_metadata_utilities","-i %s --operate keep_column image"%fnComplementary)
if ComplementaryClasses!="":
fnAux=os.path.join(WorkingDirStructureExtended,"aux.xmd")
runJob(log,"xmipp_metadata_utilities","-i %s -o %s --operate keep_column image"%(ComplementaryClasses,fnAux))
runJob(log,"xmipp_metadata_utilities", "-i %s --set union %s image image"%(fnComplementary,fnAux))
deleteFile(log,fnAux)
runJob(log,"xmipp_metadata_utilities", "-i %s --set subtraction %s image image"%(fnComplementary,fnCore))
for i in range(NumVolumes):
# Projection matching with the complementary images
fnVolume=os.path.join(WorkingDirStructureCore,"proposedVolume%05d.vol"%i)
fnAngles=os.path.join(WorkingDirStructureExtended,"anglesComplementary%05d.xmd"%i)
projMatch(log,fnVolume,AngularSampling,SymmetryGroup,fnComplementary,WorkingDirStructureExtended,fnAngles,NumberOfMpi)
# Calculate minimum correlation
fnInliers=fnVolume=os.path.join(WorkingDirStructureCore,"proposedVolume%05d.xmd"%i)
md=MetaData(fnInliers)
cc=md.getColumnValues(MDL_MAXCC)
cc.sort()
minCC=min(cc[0],CorrThresh)
# Choose those complementary images whose correlation is larger than the minimum
fnAnglesChosen=os.path.join(WorkingDirStructureExtended,"anglesComplementaryChosen%05d.xmd"%i)
runJob(log,"xmipp_metadata_utilities",'-i %s --query select "maxCC>%f" -o %s'%(fnAngles,minCC,fnAnglesChosen))
fnExtended=os.path.join(WorkingDirStructureExtended,"proposedVolume%05d.xmd"%i)
runJob(log,"xmipp_metadata_utilities",'-i %s --set union %s -o %s'%(fnInliers,fnAnglesChosen,fnExtended))
deleteFile(log,fnAngles)
deleteFile(log,fnAnglesChosen)
fnOutOfCore=os.path.join(WorkingDirStructureExtended,"imagesOutOfCore%05d.xmd"%i)
runJob(log,"xmipp_metadata_utilities",'-i %s --set subtraction %s -o %s'%(RemainingClasses,fnExtended,fnOutOfCore))
runJob(log,"xmipp_metadata_utilities",'-i %s --operate sort'%fnOutOfCore)
runJob(log,"xmipp_metadata_utilities",'-i %s --operate drop_column scale'%fnOutOfCore)
runJob(log,"xmipp_metadata_utilities",'-i %s --operate sort'%fnExtended)
deleteFile(log,os.path.join(WorkingDirStructureExtended,"gallery.stk"))
def projMatch(log, WorkingDir,WorkingDirStructure, fnClasses, fnBase, AngularSampling, SymmetryGroup, Xdim):
fnRoot=os.path.join(WorkingDirStructure,fnBase)
fnGallery=os.path.join(WorkingDir,'tmp/gallery_'+fnBase+'.stk')
AngularSampling=int(max(floor(AngularSampling/2.0),2));
runJob(log,"xmipp_angular_project_library", "-i %s.vol -o %s --sampling_rate %f --sym %s --method fourier 1 0.25 bspline --compute_neighbors --angular_distance -1 --experimental_images %s -v 0"\
%(fnRoot,fnGallery,float(AngularSampling),SymmetryGroup,fnClasses))
runJob(log,"xmipp_angular_projection_matching", "-i %s.xmd -o %s.xmd --ref %s --Ri 0 --Ro %s --max_shift %s --append -v 0"\
%(fnRoot,fnRoot,fnGallery,str(Xdim/2),str(Xdim/20)))
deleteFile(log,os.path.join(WorkingDir,'tmp/gallery_'+fnBase+'_sampling.xmd'))
deleteFile(log,os.path.join(WorkingDir,'tmp/gallery_'+fnBase+'.doc'))
deleteFile(log,os.path.join(WorkingDir,'tmp/gallery_'+fnBase+'.stk'))
def estimateSingleCTF(log, WorkingDir, inputFile, DownsampleFactor, AutomaticDownsampling,
Voltage, SphericalAberration, AngPix, AmplitudeContrast, LowResolCutoff,
HighResolCutoff,WinSize,MaxFocus,MinFocus,FastDefocus,MDL_TYPE):
extraDir=os.path.join(WorkingDir,'extra')
tmpDir=os.path.join(WorkingDir,'tmp')
micrographName = os.path.basename(inputFile)
shortname = os.path.splitext(micrographName)[0]
micrographDir = os.path.join(extraDir,shortname)
oroot="%s/xmipp_ctf"%micrographDir
if not os.path.exists(micrographDir):
createDir(log,micrographDir)
downsampleList=[DownsampleFactor]
if AutomaticDownsampling:
downsampleList.append(DownsampleFactor+1)
if DownsampleFactor>=2:
downsampleList.append(DownsampleFactor-1)
else:
downsampleList.append(max(DownsampleFactor/2.,1.))
for DownsampleFactor in downsampleList:
# Downsample if necessary
deleteTmp=False
if DownsampleFactor != 1:
finalname = os.path.join(tmpDir,shortname + "_tmp.mrc")
runJob(log,"xmipp_transform_downsample","-i %s -o %s --step %f --method fourier" % (inputFile,finalname,DownsampleFactor))
deleteTmp=True
else:
finalname = inputFile
# CTF estimation with Xmipp
args="--micrograph "+finalname+\
" --oroot "+oroot+\
" --kV "+str(Voltage)+\
" --Cs "+str(SphericalAberration)+\
" --sampling_rate "+str(AngPix*DownsampleFactor)+\
" --downSamplingPerformed "+str(DownsampleFactor)+\
" --ctfmodelSize 256"+\
" --Q0 "+str(AmplitudeContrast)+\
" --min_freq "+str(LowResolCutoff)+\
" --max_freq "+str(HighResolCutoff)+\
" --pieceDim "+str(WinSize)+\
" --defocus_range "+str((MaxFocus-MinFocus)*10000/2)+\
" --defocusU "+str((MaxFocus+MinFocus)*10000/2)
if (FastDefocus):
args+=" --fastDefocus"
runJob(log,'xmipp_ctf_estimate_from_micrograph', args)
if deleteTmp:
deleteFile(log, finalname)
md = xmipp.MetaData()
id = md.addObject()
if MDL_TYPE == xmipp.MDL_MICROGRAPH_MOVIE:
md.setValue(xmipp.MDL_MICROGRAPH_MOVIE,inputFile,id)
md.setValue(xmipp.MDL_MICROGRAPH,('%05d@%s'%(1,inputFile)),id)
else:
md.setValue(xmipp.MDL_MICROGRAPH,inputFile,id)
md.setValue(xmipp.MDL_PSD,oroot+".psd",id)
md.setValue(xmipp.MDL_PSD_ENHANCED,oroot+"_enhanced_psd.xmp",id)
md.setValue(xmipp.MDL_CTF_MODEL,oroot+".ctfparam",id)
md.setValue(xmipp.MDL_IMAGE1,oroot+"_ctfmodel_quadrant.xmp",id)
md.setValue(xmipp.MDL_IMAGE2,oroot+"_ctfmodel_halfplane.xmp",id)
md.setValue(xmipp.MDL_CTF_DOWNSAMPLE_PERFORMED,float(DownsampleFactor),id)
fnEval=os.path.join(micrographDir,"xmipp_ctf.xmd")
md.write(fnEval)
criterion="ctfCritFirstZero<5 OR ctfCritMaxFreq>20 OR ctfCritfirstZeroRatio<0.9 OR ctfCritfirstZeroRatio>1.1 OR "\
"ctfCritFirstMinFirstZeroRatio>10 OR ctfCritCorr13<0 OR ctfCritCtfMargin<0 OR ctfCritNonAstigmaticValidty<0.3 OR " \
"ctfCritNonAstigmaticValidty>25"
runJob(log,"xmipp_ctf_sort_psds","-i %s"%(fnEval))
fnRejected=os.path.join(tmpDir,shortname+"_rejected.xmd")
runJob(log,"xmipp_metadata_utilities",'-i %s --query select "%s" -o %s'%(fnEval,criterion,fnRejected))
md.read(fnRejected)
if md.size()==0:
break
def ransacIteration(log,WorkingDir,n,SymmetryGroup,Xdim,Xdim2,NumGrids,NumSamples,DimRed,InitialVolume,AngularSampling,UseSA,
NIterRandom,Rejection):
fnBase="ransac%05d"%n
TmpDir=os.path.join(WorkingDir,"tmp")
fnRoot=os.path.join(TmpDir,fnBase)
fnOutputReducedClass = os.path.join(WorkingDir,"extra/reducedClasses.xmd")
if (DimRed=='Yes'):
# Get a random sample of images
runJob(log,"xmipp_transform_dimred","-i %s --randomSample %s.xmd %d -m LTSA "%(fnOutputReducedClass,fnRoot,NumGrids))
else:
runJob(log,"xmipp_metadata_utilities","-i %s -o %s.xmd --operate random_subset %d --mode overwrite "%(fnOutputReducedClass,fnRoot,NumSamples))
runJob(log,"xmipp_metadata_utilities","-i %s.xmd --fill angleRot rand_uniform -180 180 "%(fnRoot))
runJob(log,"xmipp_metadata_utilities","-i %s.xmd --fill angleTilt rand_uniform 0 180 "%(fnRoot))
runJob(log,"xmipp_metadata_utilities","-i %s.xmd --fill anglePsi rand_uniform 0 360 "%(fnRoot))
# If there is an initial volume, assign angles
if (InitialVolume != ''):
fnGallery=os.path.join(TmpDir,'gallery_InitialVolume.stk')
runJob(log,"xmipp_angular_projection_matching", "-i %s.xmd -o %s.xmd --ref %s --Ri 0 --Ro %s --max_shift %s --append"\
%(fnRoot,fnRoot,fnGallery,str(Xdim/2),str(Xdim/20)))
# Reconstruct with the small sample
reconstruct(log,fnRoot,SymmetryGroup,Xdim2/2)
fnVol = fnRoot+'.vol'
# Simulated annealing
if UseSA:
smallIter=int(min(floor(NIterRandom/5.0),0));
runJob(log,"xmipp_volume_initial_simulated_annealing","-i %s --initial %s --oroot %s_sa --sym %s --randomIter %d --rejection %f --dontApplyPositive"
%(fnRoot+".xmd",fnVol,fnRoot,SymmetryGroup,smallIter,Rejection))
moveFile(log, fnRoot+"_sa.vol", fnVol)
deleteFile(log, fnRoot+"_sa.xmd")
# Generate projections from this reconstruction
fnGallery=os.path.join(TmpDir,'gallery_'+fnBase+'.stk')
runJob(log,"xmipp_angular_project_library", "-i %s -o %s --sampling_rate %f --sym %s --method fourier 1 0.25 bspline --compute_neighbors --angular_distance -1 --experimental_images %s"\
%(fnVol,fnGallery,float(AngularSampling),SymmetryGroup,fnOutputReducedClass))
# Assign angles to the rest of images
fnAngles=os.path.join(TmpDir,'angles_'+fnBase+'.xmd')
runJob(log,"xmipp_angular_projection_matching", "-i %s -o %s --ref %s --Ri 0 --Ro %s --max_shift %s --append"\
%(fnOutputReducedClass,fnAngles,fnGallery,str(Xdim/2),str(Xdim/20)))
# Delete intermediate files
deleteFile(log,fnGallery)
deleteFile(log,os.path.join(TmpDir,'gallery_'+fnBase+'_sampling.xmd'))
deleteFile(log,os.path.join(TmpDir,'gallery_'+fnBase+'.doc'))
deleteFile(log,fnVol)
deleteFile(log,os.path.join(TmpDir,fnBase+'.xmd'))
