本文整理匯總了Python中ParmedTools.ParmedActions.scale方法的典型用法代碼示例。如果您正苦於以下問題:Python ParmedActions.scale方法的具體用法?Python ParmedActions.scale怎麽用?Python ParmedActions.scale使用的例子?那麽, 這裏精選的方法代碼示例或許可以為您提供幫助。您也可以進一步了解該方法所在類ParmedTools.ParmedActions
的用法示例。
在下文中一共展示了ParmedActions.scale方法的1個代碼示例,這些例子默認根據受歡迎程度排序。您可以為喜歡或者感覺有用的代碼點讚,您的評價將有助於係統推薦出更棒的Python代碼示例。
示例1: scale
# 需要導入模塊: from ParmedTools import ParmedActions [as 別名]
# 或者: from ParmedTools.ParmedActions import scale [as 別名]
def scale(root, amber_prmtop, messages):
""" Allows us to scale every value in a particular prmtop section """
# The spinbox is sent with the Spinbox, label, and then a list of all of the
# values to give to it
changeable_properties = ['Spinbox', 'Property to scale']
for flag in amber_prmtop.parm.flag_list:
if amber_prmtop.parm.formats[flag].type is float:
changeable_properties.append(flag)
widget_list = [changeable_properties, ('Entry', 'Value to scale by')]
# We need 2 string variables, then get the description
var_list = [StringVar(), StringVar()]
description = 'Scales all values in a given prmtop section by a given value'
# Create the window, open it, then wait for it to close
cmd_window = _guiwidgets.ActionWindow('scale', amber_prmtop,
widget_list, var_list, description)
cmd_window.wait_window()
# See if we got any variables back
vars_found = var_list[0].get() or var_list[1].get()
if not vars_found: return
# If we did, store them and pass it to the class
var_list = [v.get() for v in var_list]
try:
action = ParmedActions.scale(amber_prmtop, ArgumentList(var_list))
except Exception, err:
showerror('Unexpected Error!', '%s: %s' % (type(err).__name__, err))
return