#!/usr/bin/env python3 # -*- coding: utf-8 -*- import re import os import pandas as pd def split_seed_file(seed_alignment_dir: str, pfam_seed_file: str, header: str): """ Pfam seed alignments are in one giant file, split into per-pfam alignment files inputs: ------- - seed_alignment_dir (str): where individual .seed files should go - pfam_seed_file: the single Pfam seed file to split - header: information to add at the top of the stats file returns: -------- (None) outputs: -------- - f'{prefix}_INIT-STATS.tsv': some initial stats after splitting """ # make the folder if seed_alignment_dir not in os.listdir(): os.mkdir(seed_alignment_dir) # split the contents of the main seed file with open(pfam_seed_file,'r', encoding='latin') as f: contents = [entry for entry in f.read().split('//\n') if entry != ''] # parse through the contents, gather stats, and output num_pfams = len(contents) num_pfams_with_clans = 0 seen_clans = set() for entry in contents: match = re.search(rf"^.*#=GF AC.*$", entry, re.MULTILINE) line_with_pfam_name = match.group(0) if match else None pfam = line_with_pfam_name.strip().split()[2].split('.')[0] del match match = re.search(rf"^.*#=GF CL.*$", entry, re.MULTILINE) line_with_clan_name = match.group(0) if match else None if line_with_clan_name != None: num_pfams_with_clans += 1 clan = line_with_clan_name.strip().split()[-1] if clan not in seen_clans: seen_clans.add(clan) with open(f'./{seed_alignment_dir}/{pfam}.seed','w') as g: g.write(entry) # write the final stats out_dict = {'Number of Pfams': num_pfams, 'Number of Pfams in clans': num_pfams_with_clans, 'Number of Unique clans': len(seen_clans)} prefix = pfam_seed_file.split('.')[0] with open(f'{prefix}_INIT-STATS.tsv', 'w') as g: g.write(f'{header}\n') [g.write(f'{key}\t{val}\n') for key, val in out_dict.items()]