comparison chembl.py @ 4:59eea7d0d720 draft

"planemo upload for repository https://github.com/chembl/chembl_webresource_client commit f5c316339ed36a0469f4862d00fa0e5cafebc041"

3:8b6ba267714b

from chembl_webresource_client.new_client import new_client
import argparse

def open_file(filename):
    with open(filename) as f:
        return f.readline()

def get_smiles(res):
    """
    Get a list of SMILES from function results
    """ 

4:59eea7d0d720

from chembl_webresource_client.new_client import new_client
import argparse

def open_file(filename):
    with open(filename) as f:
        return f.readline().split()[0]

def get_smiles(res):
    """
    Get a list of SMILES from function results
    """