@@ -0,0 +1,765 @@
+import os%0Aimport glob%0Aimport shutil%0Aimport tqdm # Provides a nice progress bar%0A%0Areceptor_dir = os.getcwd()%0Aligand_dir = %22C:%5CAutodock-MGL-1.5.6%5Cligands%5Ccin%5C%5C%22 # %3C%3C%3C Remember to change this%0Aos.chdir(ligand_dir)%0Aligands = glob.glob(%22*.pdbqt%22)%0Aos.chdir(receptor_dir)%0A%0Awith open(%22config.txt%22) as config_file:%0A    for line in config_file.readlines():%0A        if line.startswith(%22receptor%22):%0A            receptor = line%5B10:%5D%0A            break%0A%0Afor ligand in tqdm.tqdm(ligands):%0A    print(%22%5Cn  Docking: %7B0%7D %3E%3E%3E %7B1%7D%22.format(ligand, receptor))%0A    os.system(%22vina.exe --config config.txt --ligand %22 + ligand_dir + ligand + %22 --log %22 + ligand%5B:-6%5D + %22.log %3E vina.txt%22)%0A    shutil.move(ligand_dir + ligand%5B:-6%5D + %22_out.pdbqt%22, receptor_dir + %22%5C%5C%22 + ligand%5B:-6%5D + %22_out.pdbqt%22)%0A

Create screen.py