From: Cezary Czaplewski Date: Mon, 22 Jan 2018 17:04:06 +0000 (+0100) Subject: FF2 name for E0LL2Y correction X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=commitdiff_plain;h=b016dd2317a9654a9997f747a24686b0e95d83ab;p=django_unres.git FF2 name for E0LL2Y correction --- diff --git a/django_simple/todo/models.py b/django_simple/todo/models.py index f5036ad..2103d7f 100644 --- a/django_simple/todo/models.py +++ b/django_simple/todo/models.py @@ -9,7 +9,7 @@ import json MIN_CHOICE = (('minimize cart','minimize'),('minimize regular','regularize'),('minimize softreg','soft regularize'),('minimize','minimize internal coordinates')) MD_START= (('extconf','extended chain'),('pdbstart','start from pdb'),('rand_conf','random chain')) MD_LANG = (('langevin','Langevin'),('berendsen','Berendsen')) -FF_CHOICE = (('FF2','JCC 30 2127 (2009) + JCTC 11 817-831 (2015)'),('opt-wtfsa-2','JCIM 57 2364-2377 (2017)')) +FF_CHOICE = (('FF2','FF2 = JCC 30 2127 (2009) + JCTC 11 817-831 (2015)'),('opt-wtfsa-2','OPT-WTFSA-2 = JCIM 57 2364-2377 (2017)')) logger = logging.getLogger(__name__) diff --git a/django_simple/todo/views.py b/django_simple/todo/views.py index 262603f..3d959f1 100644 --- a/django_simple/todo/views.py +++ b/django_simple/todo/views.py @@ -209,7 +209,7 @@ def add_min_a(request,task_id): if form.is_valid(): task.name=form.cleaned_data["name"] task.type="min" - task.min_choice=form.cleaned_data["min_choice"] +# task.min_choice=form.cleaned_data["min_choice"] task.min_overlap=form.cleaned_data["min_overlap"] task.min_searchsc=form.cleaned_data["min_searchsc"] task.min_maxmin=form.cleaned_data["min_maxmin"]