Commit 4d0a0852 authored by Jacob Durrant's avatar Jacob Durrant

Increased version number to 1.2.1.

parent 9637dc0d
Dimorphite-DL 1.2
=================
Dimorphite-DL 1.2.1
===================
What is it?
-----------
......@@ -34,7 +34,7 @@ usage: dimorphite_dl.py [-h] [--min_ph MIN] [--max_ph MAX]
[--smiles_file FILE] [--output_file FILE]
[--label_states] [--test]
Dimorphite 1.2: Creates models of appropriately protonated small moleucles.
Dimorphite 1.2.1: Creates models of appropriately protonated small moleucles.
Apache 2.0 License. Copyright 2018 Jacob D. Durrant.
optional arguments:
......
......@@ -137,10 +137,10 @@ class ArgParseFuncs:
:return: A parser object.
"""
parser = MyParser(description="Dimorphite 1.2: Creates models of " +
"appropriately protonated small moleucles. " +
"Apache 2.0 License. Copyright 2018 Jacob D. " +
"Durrant.")
parser = MyParser(description="Dimorphite 1.2.1: Creates models of " +
"appropriately protonated small moleucles. " +
"Apache 2.0 License. Copyright 2018 Jacob D. " +
"Durrant.")
parser.add_argument('--min_ph', metavar='MIN', type=float, default=6.4,
help='minimum pH to consider (default: 6.4)')
parser.add_argument('--max_ph', metavar='MAX', type=float, default=8.4,
......
Markdown is supported
0% or
You are about to add 0 people to the discussion. Proceed with caution.
Finish editing this message first!
Please register or to comment