#!/usr/bin/python import os,re,sys,math,numpy,string from optparse import OptionParser, Option # ----------------------------- class extendableOption(Option): # ----------------------------- # used for definition of new option parser action 'extend', which enables to take multiple option arguments # taken from online tutorial http://docs.python.org/library/optparse.html ACTIONS = Option.ACTIONS + ("extend",) STORE_ACTIONS = Option.STORE_ACTIONS + ("extend",) TYPED_ACTIONS = Option.TYPED_ACTIONS + ("extend",) ALWAYS_TYPED_ACTIONS = Option.ALWAYS_TYPED_ACTIONS + ("extend",) def take_action(self, action, dest, opt, value, values, parser): if action == "extend": lvalue = value.split(",") values.ensure_value(dest, []).extend(lvalue) else: Option.take_action(self, action, dest, opt, value, values, parser) def prefixMultiply(what,len): return {True: ['%i_%s'%(i+1,what) for i in range(len)], False:[what]}[len>1] # -------------------------------------------------------------------- # MAIN # -------------------------------------------------------------------- parser = OptionParser(option_class=extendableOption, usage='%prog options [file[s]]', description = """ Add column(s) containing Cauchy stress based on given column(s) of deformation gradient and first Piola--Kirchhoff stress. """ + string.replace('$Id$','\n','\\n') ) parser.add_option('-m','--memory', dest='memory', action='store_true', \ help='load complete file into memory [%default]') parser.add_option('-f','--defgrad', dest='defgrad', type='string', \ help='heading of columns containing deformation gradient [%default]') parser.add_option('-p','--stress', dest='stress', type='string', \ help='heading of columns containing first Piola--Kirchhoff stress [%default]') parser.set_defaults(memory = False) parser.set_defaults(defgrad = 'f') parser.set_defaults(stress = 'p') (options,filenames) = parser.parse_args() if options.defgrad == None or options.stress == None: parser.error('missing data column...') datainfo = { # list of requested labels per datatype 'defgrad': {'len':9, 'label':[]}, 'stress': {'len':9, 'label':[]}, } datainfo['defgrad']['label'].append(options.defgrad) datainfo['stress']['label'].append(options.stress) # ------------------------------------------ setup file handles --------------------------------------- files = [] if filenames == []: files.append({'name':'STDIN', 'handle':sys.stdin}) else: for name in filenames: if os.path.exists(name): files.append({'name':name, 'input':open(name), 'output':open(name+'_tmp','w')}) # ------------------------------------------ loop over input files --------------------------------------- for file in files: print file['name'] # get labels by either read the first row, or - if keyword header is present - the last line of the header firstline = file['input'].readline() m = re.search('(\d+)\s*head', firstline.lower()) if m: headerlines = int(m.group(1)) passOn = [file['input'].readline() for i in range(1,headerlines)] headers = file['input'].readline().split() else: headerlines = 1 passOn = [] headers = firstline.split() if options.memory: data = file['input'].readlines() else: data = [] for i,l in enumerate(headers): if l.startswith('1_'): if re.match('\d+_',l[2:]) or i == len(headers)-1 or not headers[i+1].endswith(l[2:]): headers[i] = l[2:] active = {} column = {} head = [] for datatype,info in datainfo.items(): for label in info['label']: key = {True :'1_%s', False:'%s' }[info['len']>1]%label if key not in headers: sys.stderr.write('column %s not found...\n'%key) else: if datatype not in active: active[datatype] = [] if datatype not in column: column[datatype] = {} active[datatype].append(label) column[datatype][label] = headers.index(key) head += prefixMultiply('Cauchy',datainfo[datatype]['len']) # ------------------------------------------ assemble header --------------------------------------- output = '%i\theader'%(headerlines+1) + '\n' + \ ''.join(passOn) + \ string.replace('$Id$','\n','\\n')+ '\t' + \ ' '.join(sys.argv[1:]) + '\n' + \ '\t'.join(headers + head) + '\n' # build extended header if not options.memory: file['output'].write(output) output = '' # ------------------------------------------ read file --------------------------------------- for line in {True : data, False : file['input']}[options.memory]: items = line.split()[:len(headers)] if len(items) < len(headers): continue output += '\t'.join(items) F = numpy.array(map(float,items[column['defgrad'][active['defgrad'][0]]: column['defgrad'][active['defgrad'][0]]+datainfo['defgrad']['len']]),'d').reshape(3,3) P = numpy.array(map(float,items[column['stress'][active['stress'][0]]: column['stress'][active['stress'][0]]+datainfo['stress']['len']]),'d').reshape(3,3) output += '\t'+'\t'.join(map(str,1.0/numpy.linalg.det(F)*numpy.dot(P,F.T).reshape(9))) # [Cauchy] = (1/det(F)) * [P].[F_transpose] output += '\n' if not options.memory: file['output'].write(output) output = '' file['input'].close() # ------------------------------------------ output result --------------------------------------- if options.memory: file['output'].write(output) if file['name'] != 'STDIN': file['output'].close os.rename(file['name']+'_tmp',file['name'])