# Path: acpype/params.py
# MAXTIME = 3 * 3600
# TLEAP_TEMPLATE = """
# verbosity 1
# source %(leapAmberFile)s
# source %(leapGaffFile)s
# mods = loadamberparams %(acBase)s.frcmod
# %(res)s = loadmol2 %(acMol2FileName)s
# check %(res)s
# saveamberparm %(res)s %(acBase)s.prmtop %(acBase)s.inpcrd
# saveoff %(res)s %(acBase)s.lib
# quit
# """


import argparse
from acpype.params import MAXTIME, epilog, outTopols, usage
    parser.add_argument(
        "-o",
        "--outtop",
        choices=["all"] + outTopols,
        action="store",
        default="all",
        dest="outtop",
        help="output topologies: all (default), gmx, cns or charmm",
    )
    parser.add_argument(
        "-z",
        "--gmx4",
        action="store_true",
        dest="gmx4",
        help="write RB dihedrals old GMX 4.0",
    )
    parser.add_argument(
        "-t",
        "--cnstop",
        action="store_true",
        dest="cnstop",
        help="write CNS topology with allhdg-like parameters (experimental)",
    )
    parser.add_argument(
        "-s",
        "--max_time",
        type=int,
        action="store",
        default=MAXTIME,
        dest="max_time",

# Path: acpype/params.py
# MAXTIME = 3 * 3600
# TLEAP_TEMPLATE = """
# verbosity 1
# source %(leapAmberFile)s
# source %(leapGaffFile)s
# mods = loadamberparams %(acBase)s.frcmod
# %(res)s = loadmol2 %(acMol2FileName)s
# check %(res)s
# saveamberparm %(res)s %(acBase)s.prmtop %(acBase)s.inpcrd
# saveoff %(res)s %(acBase)s.lib
# quit
# """


# Path: acpype/parser_args.py
import argparse
from acpype.params import MAXTIME, epilog, outTopols, usage

    parser.add_argument(
        "-o",
        "--outtop",
        choices=["all"] + outTopols,
        action="store",
        default="all",
        dest="outtop",
        help="output topologies: all (default), gmx, cns or charmm",
    )
    parser.add_argument(
        "-z",
        "--gmx4",
        action="store_true",
        dest="gmx4",
        help="write RB dihedrals old GMX 4.0",
    )
    parser.add_argument(
        "-t",
        "--cnstop",
        action="store_true",
        dest="cnstop",
        help="write CNS topology with allhdg-like parameters (experimental)",
    )
    parser.add_argument(
        "-s",
        "--max_time",
        type=int,
        action="store",
        default=MAXTIME,
        dest="max_time",

        help="max time (in sec) tolerance for sqm/mopac, default is %i hours" % (MAXTIME // 3600),