Source code for aquaduct.utils.maths
# -*- coding: utf-8 -*-
# Aqua-Duct, a tool facilitating analysis of the flow of solvent molecules in molecular dynamic simulations
# Copyright (C) 2016-2018 Tomasz Magdziarz, Alicja Płuciennik, Michał Stolarczyk <info@aquaduct.pl>
#
# This program is free software: you can redistribute it and/or modify
# it under the terms of the GNU General Public License as published by
# the Free Software Foundation, either version 3 of the License, or
# (at your option) any later version.
#
# This program is distributed in the hope that it will be useful,
# but WITHOUT ANY WARRANTY; without even the implied warranty of
# MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
# GNU General Public License for more details.
#
# You should have received a copy of the GNU General Public License
# along with this program. If not, see <http://www.gnu.org/licenses/>.
import numpy as np
[docs]class NumpyDefaultsStorageTypes(object):
float_default = np.float64
int_default = np.int64
defaults = NumpyDefaultsStorageTypes()
[docs]def make_default_array(array_like):
if isinstance(array_like,np.ndarray):
return array_like.astype(defaults.float_default)
return np.array(array_like).astype(defaults.float_default)