Mercurial > repos > bornea > saint_preprocessing
view mzID_process2.py @ 80:6ad498eac0e2 draft default tip
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author | bornea |
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date | Sat, 06 May 2017 09:38:25 -0400 |
parents | 211fd8ae6edc |
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# -*- coding: utf-8 -*- """ Python-code: Preprocess mzIdentML @author = Brent Kuenzi @email = Brent.Kuenzi@moffitt.org """ ####################################################################################### ## Description: ## #This program will create inter, prey, and bait files from mzIdentML files ## Required input: ## # 1) mzIdentML file to be reformatted # 2) minimum PSM for quantification import sys import os ins_path = sys.argv[5] class ReturnValue1(object): def __init__(self, sequence, gene): self.seqlength = sequence self.genename = gene class ReturnValue2(object): def __init__(self, inter, accessions): self.inter = inter self.accessions = accessions def read_tab(infile): with open(infile,'r') as x: output = [] for line in x: line = line.strip() temp = line.split('\t') output.append(temp) return output def printProgress (iteration, total, prefix = '', suffix = '', decimals = 1, barLength = 100): """ Call in a loop to create terminal progress bar @params: iteration - Required : current iteration (Int) total - Required : total iterations (Int) prefix - Optional : prefix string (Str) suffix - Optional : suffix string (Str) decimals - Optional : positive number of decimals in percent complete (Int) barLength - Optional : character length of bar (Int) """ formatStr = "{0:." + str(decimals) + "f}" percents = formatStr.format(100 * (iteration / float(total))) filledLength = int(round(barLength * iteration / float(total))) bar = '=' * filledLength + '-' * (barLength - filledLength) sys.stdout.write('\r%s |%s| %s%s %s' % (prefix, bar, percents, '%', suffix)), sys.stdout.flush() if iteration == total: sys.stdout.write('\n') sys.stdout.flush() def get_info(uniprot_accession_in,fasta_db): # Get aminoacid lengths and gene name. error = open('error proteins.txt', 'a+') data = open(fasta_db, 'r') data_lines = data.readlines() db_len = len(data_lines) seqlength = 0 count = 0 last_line = data_lines[-1] for data_line in data_lines: if ">sp" in data_line: namer = data_line.split("|")[2] if uniprot_accession_in == data_line.split("|")[1]: match = count + 1 if 'GN=' in data_line: lst = data_line.split('GN=') lst2 = lst[1].split(' ') genename = lst2[0] if 'GN=' not in data_line: genename = 'NA' while ">sp" not in data_lines[match]: if match <= db_len: seqlength = seqlength + len(data_lines[match].strip()) if data_lines[match] == last_line: break match = match + 1 else: break return ReturnValue1(seqlength, genename) if uniprot_accession_in == namer.split(" ")[0]: match = count + 1 # Ensures consistent spacing throughout. if 'GN=' in data_line: lst = data_line.split('GN=') lst2 = lst[1].split(' ') genename = lst2[0] if 'GN=' not in data_line: genename = 'NA' while ">sp" not in data_lines[match]: if match <= db_len: seqlength = seqlength + len(data_lines[match].strip()) if data_lines[match] == last_line: break match = match + 1 else: break return ReturnValue1(seqlength, genename) count = count + 1 if seqlength == 0: error.write(uniprot_accession_in + '\t' + "Uniprot not in Fasta" + '\n') error.close seqlength = 'NA' genename = 'NA' return ReturnValue1(seqlength, genename) def make_inter(mzIdentML,replicate,grouping): accession_index = mzIdentML[0].index("accession") PSMs = {} accessions = [] cnt = 0 unique_lines = [mzIdentML[1:]] for i in mzIdentML[1:]: PSMs[i[accession_index]] = 0 if i[accession_index] not in accessions: accessions.append(i[accession_index]) if i not in unique_lines: unique_lines.append(i) for i in accessions: for j in unique_lines[1:]: if j[accession_index] == i: PSMs[j[accession_index]] +=1 inter = "" for i in accessions: inter = inter + replicate + "\t" + grouping + "\t" + i + "\t" + str(PSMs[i]) + "\n" return ReturnValue2(inter,accessions) files = sys.argv[1] file_list = files.split(",") make_prey = sys.argv[3] db = sys.argv[4] if db == "None": db = str(ins_path) + "/SwissProt_HUMAN_2015_12.fasta" make_bait = sys.argv[6] bait_bool = sys.argv[7] prey_file = sys.argv[8] bait_out = sys.argv[9] inter_out = sys.argv[10] def bait_create(baits): # Verifies the Baits are valid in the Scaffold file and writes the Bait.txt. baits = make_bait.split() i = 0 bait_file_tmp = open("bait.txt", "w") order = [] bait_cache = [] while i < len(baits): if baits[i+2] == "true": T_C = "C" else: T_C = "T" bait_line = baits[i] + "\t" + baits[i+1] + "\t" + T_C + "\n" bait_cache.append(str(bait_line)) i = i + 3 for cache_line in bait_cache: bait_file_tmp.write(cache_line) bait_file_tmp.close() if bait_bool == 'false': bait_create(make_bait, infile) bait = "bait.txt" else: bait_temp_file = open(sys.argv[2], 'r') bait_cache = bait_temp_file.readlines() bait_file_tmp = open("bait.txt", "wr") for cache_line in bait_cache: bait_file_tmp.write(cache_line) bait_file_tmp.close() bait = "bait.txt" bait = read_tab("bait.txt") inter = "" cnt = 0 accessions = [] for i in file_list: cmd = (r"Rscript "+ str(ins_path) +"flatten_mzIdentML.R " + i) os.system(cmd) mzIdentML = read_tab("flat_mzIdentML.txt") inter = inter + make_inter(mzIdentML,bait[cnt][0],bait[cnt][1]).inter accessions.append(make_inter(mzIdentML,bait[cnt][0],bait[cnt][1]).accessions) cnt+=1 with open("inter.txt","w") as x: x.write(inter) if make_prey == "true": unique_accessions = [] prey = "" for i in accessions: for j in i: if j not in unique_accessions: unique_accessions.append(j) start = 0 end = len(unique_accessions) printProgress(start,end,prefix = "Making Prey File:",suffix = "Complete",barLength=50) for i in unique_accessions: prey = prey + i + "\t" + str(get_info(i,db).seqlength) + "\t" + get_info(i,db).genename + "\n" start+=1 printProgress(start, end) with open("prey.txt","w") as x: x.write(prey) os.rename("bait.txt", bait_out) os.rename("inter.txt", inter_out) if str(prey_file) != "None": os.rename("prey.txt", prey_file)