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metagenomics_CB.py
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metagenomics_CB.py
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import argparse
import subprocess
import os
import re
import glob
import sys
import time
###########################
#Argument parsing
###########################
# Gather input files and variables from command line
parser = argparse.ArgumentParser(description='Runs holoflow pipeline.')
parser.add_argument('-f', help="input.txt file", dest="input_txt", required=True)
parser.add_argument('-d', help="temp files directory path", dest="work_dir", required=True)
parser.add_argument('-c', help="config file", dest="config_file", required=False)
parser.add_argument('-k', help="keep tmp directories", dest="keep", action='store_true')
parser.add_argument('-l', help="pipeline log file", dest="log", required=False)
parser.add_argument('-t', help="threads", dest="threads", required=True)
parser.add_argument('-W', help="threads", dest="REWRITE", action='store_true')
args = parser.parse_args()
in_f=args.input_txt
path=args.work_dir
cores=args.threads
# retrieve current directory
file = os.path.dirname(sys.argv[0])
curr_dir = os.path.abspath(file)
# If the user does not specify a config file, provide default file in GitHub
current_time = time.strftime("%m.%d.%y_%H:%M", time.localtime())
if not (args.config_file):
cpconfigCmd= 'cp '+curr_dir+'/workflows/metagenomics/coassembly_binning/config.yaml '+path+'/'+current_time+'_config.yaml'
subprocess.Popen(cpconfigCmd,shell=True).wait()
config = path+'/'+current_time+'_config.yaml'
else:
config=args.config_file
# If the user does not specify a log file, provide default path
if not (args.log):
log = os.path.join(path,"Holoflow_coassembly_metagenomics.log")
else:
log=args.log
# Load dependencies
loaddepCmd='module unload gcc && module load tools anaconda3/4.4.0'
subprocess.Popen(loaddepCmd,shell=True).wait()
#Append variables to .yaml config file for Snakefile calling standalone files
import ruamel.yaml
yaml = ruamel.yaml.YAML() # create yaml obj
yaml.explicit_start = True
with open(str(config), 'r') as config_file:
data = yaml.load(config_file)# get data found now in config - as dictionary
if data == None: # if config is empty, create dictionary
data = {}
with open(str(config), 'w') as config_file:
data['threads'] = str(cores)
data['holopath'] = str(curr_dir)
data['logpath'] = str(log)
dump = yaml.dump(data, config_file) # load updated dictionary to config file
###########################
## Functions
###########################
###########################
###### METAGENOMICS FUNCTIONS
def in_out_metagenomics(path,in_f):
"""Generate output names files from input.txt. Rename and move
input files where snakemake expects to find them if necessary."""
in_dir = os.path.join(path,"PPR_03-MappedToReference")
merged_in_dir = os.path.join(path,"MCB_00-MergedData")
if not os.path.exists(in_dir): # create dir with all files to input to co-assembly
os.makedirs(in_dir)
else:
pass
# create dir for merged files (2 files containing data of all inputted files)
if not os.path.exists(merged_in_dir):
os.makedirs(merged_in_dir)
else:
pass
with open(in_f,'r') as in_file:
# Define necessary variables
coa_group = False # coassembly group ID still not defined
coa1_filename=''
coa2_filename=''
read1_files=''
list_read1=list()
read2_files=''
list_read2=list()
output_files=''
final_temp_dir="MCB_04-BinMerging"
all_lines = in_file.readlines() # Read input.txt lines
# remove empty lines
all_lines = map(lambda s: s.strip(), all_lines)
lines = list(filter(None, list(all_lines))) # save input file content withput blank lines in "lines"
last_line = lines[-1].split(' ') # last line of input file
for line in lines:
if not (line.startswith('#')):
line = line.strip('\n').split(' ') # Create a list of each line
sample=str(line[0]) # sample ID
if (coa_group == line[1]) or not coa_group: # If sample in same coa group or not defined yet
read1_files+=line[2]+' '
read2_files+=line[3]+' '
coa_group=line[1]
if coa_group and not (coa_group == line[1]): # When the coa group is defined and changes, define output files for previous group and finish input
# Fill in PPR_03 of uniformely renamed files
input_dir = in_dir+'/'+coa_group
if os.path.exists(input_dir):
if args.REWRITE: # If user wants to remove previous runs' data and run from scratch
rmCmd='rm -rf '+input_dir+''
subprocess.Popen(rmCmd,shell=True).wait()
else:
pass
if not os.path.exists(input_dir): # if input directory does not exist
os.makedirs(input_dir)
###### Handle individual sample files before merging them
list_read1=read1_files.strip().split(' ')
list_read2=read2_files.strip().split(' ')
for file1 in list_read1:
file=os.path.basename(file1)
# fastq inputted files to coassembly can have various nomenclatures
# _1.fastq, _1.fq, .1.fastq, .1.fq, etc.
#This command retrieves the file ID without format and for/rev number
sampleID=re.sub('(\.|_)[0-9]{1}\.f[aA-zZ]*\.?.*','',file)
# create a standardized directory with standardized IDs to coassemble
if file1.endswith('.gz'):
read1=input_dir+'/'+sampleID+'_1.fastq.gz'
else:
read1=input_dir+'/'+sampleID+'_1.fastq'
try:
cp1Cmd='ln -s '+file1+' '+read1+'' # If the file already existed, won't create link
subprocess.Popen(cp1Cmd, shell=True).wait()
except:
pass
for file2 in list_read2:
file=os.path.basename(file2)
sampleID=re.sub('(\.|_)[0-9]{1}\.f[aA-zZ]*\.?.*','',file)
if file2.endswith('.gz'):
read2=in_dir+'/'+coa_group+'/'+sampleID+'_2.fastq.gz'
else:
read2=in_dir+'/'+coa_group+'/'+sampleID+'_2.fastq'
try:
cp2Cmd='ln -s '+file2+' '+read2+'' # If the file already existed, won't create link
subprocess.Popen(cp2Cmd, shell=True).wait()
except:
pass
###### Create coassembly merged files from all individual samples
coa1_filename=(str(merged_in_dir)+'/'+str(coa_group)+'_1.fastq')
coa2_filename=(str(merged_in_dir)+'/'+str(coa_group)+'_2.fastq')
# if the forward read merged file exists, choose if rewrite or not
if os.path.isfile(coa1_filename):
if args.REWRITE: # If user wants to remove previous runs' data and run from scratch
rmCmd='rm '+coa1_filename+' '+coa2_filename+''
subprocess.Popen(rmCmd,shell=True).wait()
else: #user wants to continue from rpevious run
pass
if not os.path.isfile(coa1_filename):
files1 = glob.glob(in_dir+'/'+coa_group+'/*_1.fastq*')
for file1 in files1:
# Create a files called ".fastq", but actually fill them with a comma-separarted
# string of all the files that want to be considered for the coassembly
# MEGAHIT accepts this string as input, while MetaSpades will require the actual
# merging of the files into 1 file: done in holo-assembly file -> only for SMALL coassemblies!
with open(coa1_filename,'a+') as coa1, open(coa2_filename,'a+') as coa2:
if file1 == files1[-1]:
coa1.write(file1.strip())
file2 = file1.strip().replace('1.fastq','2.fastq')
coa2.write(file2.strip())
else:
coa1.write(file1.strip()+',')
file2 = file1.strip().replace('1.fastq','2.fastq')
coa2.write(file2.strip()+',')
# Define Snakemake output files
output_files+=(path+"/"+final_temp_dir+"/"+coa_group+"_files ")
# Define new coa group
coa_group=line[1]
read1_files=''
read1_files+=line[2]+' '
list_read1=list()
read2_files=''
read2_files+=line[3]+' '
list_read2=list()
if line == last_line: # in this case it is as if the coassembly group was changing, finish
# Fill in PPR_03 of uniformely renamed files
input_dir = in_dir+'/'+coa_group
if os.path.exists(input_dir):
if args.REWRITE:
rmCmd='rm -rf '+input_dir+''
subprocess.Popen(rmCmd,shell=True).wait()
else:
pass
if not os.path.exists(input_dir):
os.makedirs(input_dir)
###### Handle individual sample files
list_read1=read1_files.strip().split(' ')
list_read2=read2_files.strip().split(' ')
for file1 in list_read1:
file=os.path.basename(file1)
sampleID=re.sub('(\.|_)[0-9]{1}\.f[aA-zZ]*\.?.*','',file)
if file1.endswith('.gz'):
read1=in_dir+'/'+coa_group+'/'+sampleID+'_1.fastq.gz'
else:
read1=in_dir+'/'+coa_group+'/'+sampleID+'_1.fastq'
try:
cp1Cmd='ln -s '+file1+' '+read1+'' # If the file already existed, won't create link
subprocess.Popen(cp1Cmd, shell=True).wait()
except:
pass
for file2 in list_read2:
file=os.path.basename(file2)
sampleID=re.sub('(\.|_)[0-9]{1}\.f[aA-zZ]*\.?.*','',file)
if file2.endswith('.gz'):
read2=in_dir+'/'+coa_group+'/'+sampleID+'_2.fastq.gz'
else:
read2=in_dir+'/'+coa_group+'/'+sampleID+'_2.fastq'
try:
cp2Cmd='ln -s '+file2+' '+read2+'' # If the file already existed, won't create link
subprocess.Popen(cp2Cmd, shell=True).wait()
except:
pass
###### Create coassembly files data
coa1_filename=(str(merged_in_dir)+'/'+str(coa_group)+'_1.fastq')
coa2_filename=(str(merged_in_dir)+'/'+str(coa_group)+'_2.fastq')
if os.path.isfile(coa1_filename):
if args.REWRITE:
rmCmd='rm '+coa1_filename+' '+coa2_filename+''
subprocess.Popen(rmCmd,shell=True).wait()
else:
pass
if not os.path.isfile(coa1_filename):
files1 = glob.glob(in_dir+'/'+coa_group+'/*_1.fastq*')
for file1 in files1:
with open(coa1_filename,'a+') as coa1, open(coa2_filename,'a+') as coa2:
if file1 == files1[-1]:
coa1.write(file1.strip())
file2 = file1.strip().replace('1.fastq','2.fastq')
coa2.write(file2.strip())
else:
coa1.write(file1.strip()+',')
file2 = file1.strip().replace('1.fastq','2.fastq')
coa2.write(file2.strip()+',')
# Define Snakemake output files
output_files+=(path+"/"+final_temp_dir+"/"+coa_group+"_files ")
return output_files
def run_metagenomics(in_f, path, config, cores):
"""Run snakemake on shell"""
# Define output names
out_files = in_out_metagenomics(path,in_f)
curr_dir = os.path.dirname(sys.argv[0])
holopath = os.path.abspath(curr_dir)
path_snkf = os.path.join(holopath,'workflows/metagenomics/coassembly_binning/Snakefile')
# Run snakemake
log_file=open(str(log),'w+')
log_file.write("Have a nice run!\n\t\tHOLOFOW Metagenomics-Coassembly starting")
log_file.close()
mtg_snk_Cmd = 'snakemake -s '+path_snkf+' -k '+out_files+' --configfile '+config+' --cores '+cores+''
subprocess.Popen(mtg_snk_Cmd, shell=True).wait()
log_file=open(str(log),'a+')
log_file.write("\n\t\tHOLOFOW Metagenomics-Coassembly has finished :)")
log_file.close()
# Keep temp dirs / remove all
if args.keep: # If -k, True: keep
pass
else: # If not -k, keep only last dir
exist=list()
for file in out_files.split(' '):
exist.append(os.path.isfile(file))
if all(exist): # all output files exist
rmCmd='cd '+path+' | grep -v '+final_temp_dir+' | xargs rm -rf && mv '+final_temp_dir+' MCB_Holoflow'
subprocess.Popen(rmCmd,shell=True).wait()
else: # all expected output files don't exist: keep tmp dirs
log_file = open(str(log),'a+')
log_file.write("Looks like something went wrong...\n\t\t The temporal directories have been kept, you should have a look...")
log_file.close()
###########################
#### Workflows running
###########################
# 2 # Metagenomics workflow
run_metagenomics(in_f, path, config, cores)