From d47b0a735095378ba95a946b820cb6444df0814a Mon Sep 17 00:00:00 2001 From: Lester Hedges Date: Thu, 22 Apr 2021 17:49:19 +0100 Subject: [PATCH] Improve description of ignore_warnings parameter. --- python/BioSimSpace/Process/_gromacs.py | 4 +++- 1 file changed, 3 insertions(+), 1 deletion(-) diff --git a/python/BioSimSpace/Process/_gromacs.py b/python/BioSimSpace/Process/_gromacs.py index bee05fb6e..47163264b 100644 --- a/python/BioSimSpace/Process/_gromacs.py +++ b/python/BioSimSpace/Process/_gromacs.py @@ -89,7 +89,9 @@ def __init__(self, system, protocol, exe=None, name="gromacs", own naming scheme, e.g. { "charge" : "my-charge" } ignore_warnings : bool - Whether to ignore warnings when generating the binary run file. + Whether to ignore warnings when generating the binary run file + with 'gmx grompp'. By default, these warnings are elevated to + errors and will halt the program. show_errors : bool Whether to show warning/error messages when generating the binary