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# -*- coding: utf-8 -*- """Tests for the PyBEL processor.""" import os from urllib import request from pybel import BELGraph from pybel.dsl import * from pybel.language import Entity from pybel.io import from_nodelink_file from pybel.examples import egf_graph from indra.statements import * from indra.sources import ...
sorgerlab/belpy
indra/tests/test_pybel_api.py
Python
mit
30,089
[ "Pybel" ]
9adebb0d4ac3378e682f81cccb76478a28a5b4341846c0e1e8229ad2ed6a65ad
#!/usr/bin/env python ''' COPYRIGHT 2013 RPS ASA This file is part of Wicken. Wicken 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...
ioos/wicken
wicken/dogma.py
Python
apache-2.0
8,388
[ "NetCDF" ]
e064e8a86c39215543944a282c057771f6040ba306e2881f09b18eb227992745
"""Timeseries model using FSL's gaussian least squares.""" import re import os.path as op import numpy as np from scipy import stats, signal import pandas as pd import nibabel as nib import matplotlib.pyplot as plt from moss import glm from moss.mosaic import Mosaic import seaborn as sns from nipype import Node, MapNo...
tuqc/lyman
lyman/workflows/model.py
Python
bsd-3-clause
20,567
[ "Gaussian" ]
2cc2119b8fe9339dae2e56d391ba9016c50aed9600f52368d0ad65ddc2b12017
# Licensed under a 3-clause BSD style license - see LICENSE.rst """ Module to test fitting routines """ from __future__ import (absolute_import, unicode_literals, division, print_function) import os.path import pytest import numpy as np from numpy import linalg from numpy.testing.utils import...
kelle/astropy
astropy/modeling/tests/test_fitters.py
Python
bsd-3-clause
25,717
[ "Gaussian" ]
8bbefc179f1217e710e173340be1108307c68a1701363df4ed03f03d56c6388a
import decimal import gc import itertools import multiprocessing import weakref import sqlalchemy as sa from sqlalchemy import ForeignKey from sqlalchemy import inspect from sqlalchemy import Integer from sqlalchemy import MetaData from sqlalchemy import select from sqlalchemy import String from sqlalchemy import test...
kawamon/hue
desktop/core/ext-py/SQLAlchemy-1.3.17/test/aaa_profiling/test_memusage.py
Python
apache-2.0
37,168
[ "VisIt" ]
efb1a45fc3024520c3dac091598b158e48732c9247f77eab3d33812752979011
# -*- coding: utf-8 -*- # Ambry Bundle Library File # Use this file for code that may be imported into other bundles class RandomSourcePipe(object): def __init__(self, bundle, source=None): if source: self.year = int(source.time) self.space = source.space else: ...
CivicKnowledge/ambry
test/bundle_tests/build.example.com/coverage/lib.py
Python
bsd-2-clause
1,571
[ "Gaussian" ]
792e11e6c40483bff7c97761a2bf1d7edcb4565d90bb0d2b19a778755297b8fb
# -*- coding: utf-8 -*- ## ## CreateInflowFileFromERAInterimRunoff.py ## spt_lsm_autorapid_process ## ## Created by Alan D. Snow (adapted from CreateInflowFileFromECMWFRunoff.py). ## Copyright © 2015-2016 Alan D Snow. All rights reserved. ## License: BSD-3 Clause import csv import netCDF4 as NET import...
erdc-cm/spt_lsm_autorapid_process
imports/CreateInflowFileFromERAInterimRunoff.py
Python
bsd-3-clause
10,290
[ "NetCDF" ]
f6b1a89073d06609840edee0982859ee84a0cf9d45af6d0284f93324019bb74d
#!/usr/bin/env python ######################################################################################### # # Convert binary spinal cord segmentation to trilinear-interpolated segmentation. Instead of simply re-interpolating # the image, this function oversample the binary mask, then smooth along centerline (to r...
neuropoly/spinalcordtoolbox
spinalcordtoolbox/scripts/isct_convert_binary_to_trilinear.py
Python
mit
7,321
[ "Gaussian" ]
6671dfd4fb85a8bd2e87adf454ba423d759db1bcf36544d9bd8086214e872f49
#!/usr/bin/env python import datetime import gevent import os import re import urllib2 import urlparse from gevent import monkey monkey.patch_all() from flask import Flask, render_template, send_from_directory, request, make_response from lxml.html import parse # initialization app = Flask(__name__) #app.config.upd...
alphagov/service-domain-checker
webapp.py
Python
mit
11,942
[ "VisIt" ]
981b23474125c19340652776f12cf1a9560c291070e9ad3e0119c37925f9284d
""" Single page performance tests for LMS. """ from nose.plugins.attrib import attr from common.test.acceptance.fixtures.course import CourseFixture, CourseUpdateDesc, XBlockFixtureDesc from common.test.acceptance.pages.common.auto_auth import AutoAuthPage from common.test.acceptance.pages.common.logout import LogoutP...
Stanford-Online/edx-platform
common/test/acceptance/performance/test_lms_performance.py
Python
agpl-3.0
4,431
[ "VisIt" ]
0f9c497ddb4a8f64f408393c310228318fed9308329eba7454b19b298b18299c
from collections import namedtuple import os import ase.io import ase.db homedir = os.path.expanduser('~') materials_dir = homedir + '/Documents/Data/materials' data_dir = homedir + '/Documents/Data/datasets/sulfur_clusters' pointgroups = {'S8':'D4d', 'S7_branched':'Cs', 'S7_ring':'Cs', 'S6_branched':'Cs', ...
WMD-group/sulfur-model
scripts/gen_sulfur_db.py
Python
gpl-3.0
3,122
[ "ASE" ]
4e6cb9123486cb30388d0eb734563eaef413397e6a0c6400ab3b52c2c0d9c66f
""" Author: Roger Labbe Copyright: 2014 This code performs various basic statistics functions for the Kalman and Bayesian Filters in Python book. Much of this code is non-optimal; production code should call the equivalent scipy.stats functions. I wrote the code in this form to make explicit how the computations are d...
maxiee/MyCodes
KalmanAndBesianFiltersInPython/Chapter6_multivariate_kalman_filter/utils/stats.py
Python
gpl-3.0
11,807
[ "Gaussian" ]
85866ee41b20d420258acc2ed3ef78fdab9bbed8094827c0757161a6de52c2cb
import math import os import sys import httplib2 import requests from apiclient.discovery import build from apiclient.errors import HttpError from oauth2client.client import flow_from_clientsecrets from oauth2client.file import Storage from oauth2client.tools import argparser, run_flow from bs4 import Beaut...
haxorjim/dormant-youtube-subscriptions
youtube-tools.py
Python
mit
6,416
[ "VisIt" ]
56f417ee5c3ddb38dd493b2f1279b9adbf75fa6ec27881f41d8adac77c684144
############################################################################## # Copyright (c) 2013-2018, Lawrence Livermore National Security, LLC. # Produced at the Lawrence Livermore National Laboratory. # # This file is part of Spack. # Created by Todd Gamblin, tgamblin@llnl.gov, All rights reserved. # LLNL-CODE-64...
EmreAtes/spack
var/spack/repos/builtin/packages/mpiblast/package.py
Python
lgpl-2.1
1,997
[ "BLAST" ]
ccadbbea827093934d5384cfeee61d08cdb3a7813d9473c1c8936272d616f5d2
# # @file TestSBMLConvert.py # @brief SBMLConvert unit tests # # @author Akiya Jouraku (Python conversion) # @author Ben Bornstein # # $Id$ # $HeadURL$ # # ====== WARNING ===== WARNING ===== WARNING ===== WARNING ===== WARNING ====== # # DO NOT EDIT THIS FILE. # # This file was generated automatically by conver...
alexholehouse/SBMLIntegrator
libsbml-5.0.0/src/bindings/python/test/sbml/TestSBMLConvert.py
Python
gpl-3.0
16,780
[ "VisIt" ]
c6e60c87d1658948c638efb52b85c1b6515ef3dda3d549ee770ef5b0469e0beb
from twisted.internet import defer, reactor from nevow import livepage, loaders, tags, rend, static, entities from nevow.livepage import js, document testFrameNode = js.testFrameNode contentDocument = testFrameNode.contentDocument import os.path resourceDirectory = os.path.dirname(__file__) class Driver(object):...
tquilian/exelearningTest
nevow/livetest.py
Python
gpl-2.0
8,724
[ "VisIt" ]
e37703838ea50010c7ac55e8383391531c9111d96bd08c70b7e465194a590db5
# $Id$ # # Copyright (C) 2002-2006 greg Landrum and Rational Discovery LLC # # @@ All Rights Reserved @@ # This file is part of the RDKit. # The contents are covered by the terms of the BSD license # which is included in the file license.txt, found at the root # of the RDKit source tree. # """unit testing code ...
jandom/rdkit
rdkit/Chem/EState/UnitTestEState.py
Python
bsd-3-clause
5,001
[ "RDKit" ]
23446bb8b4cf2b02702ee04691c6779d172804c8d0a385c966e6b35693c80c96
#! /usr/bin/env python # FIXME: it has to be seen if this is any useful # FIXME: to bring back to life from DIRAC.Core.Base.Script import parseCommandLine parseCommandLine() from DIRAC.Resources.Catalog.FileCatalog import FileCatalog from DIRAC.Core.Utilities.File ...
Andrew-McNab-UK/DIRAC
tests/Integration/Resources/Catalog/FIXME_Test_CatalogPlugin.py
Python
gpl-3.0
18,087
[ "DIRAC" ]
15d9b17acdca5cb24b75e4cd4d7e1a46e66bf35dd63d2308405bef46249eab72
""" A setuptools based setup module. See: https://packaging.python.org/guides/distributing-packages-using-setuptools/ https://github.com/pypa/sampleproject """ """ THIS FILE IS USED IN THE DOCS BUILDING DO NOT DELETE! """ # Always prefer setuptools over distutils from setuptools import setup, find_packages import os ...
SanPen/GridCal
setup.py
Python
lgpl-3.0
9,976
[ "VisIt" ]
dc93abe0677db2e60ffa729d233595597b119f62b9eb40e8d2956b4ed81f3ee8
import re, math from django.contrib.gis.db import models from gass.bering.utils import * class Station(models.Model): ''' Ablatometer station, idealized i.e. designation B01 is re-used each year. ''' site = models.CharField(max_length=255, unique=True) operational = models.BooleanField(help_text="I...
arthur-e/gass
bering/models.py
Python
mit
17,849
[ "VisIt" ]
c0737b5d2aa6985ff368be36c37dfe67b14f4d2219fb0d3196fe71c7c82a134a
import logging import os from pyjade import Compiler as _Compiler, Parser, register_filter from pyjade.runtime import attrs from pyjade.exceptions import CurrentlyNotSupported from pyjade.utils import process from django.conf import settings class Compiler(_Compiler): autocloseCode = 'if,ifchanged,ifequal,ifnote...
paradoxxxzero/pyjade
pyjade/ext/django/compiler.py
Python
mit
4,177
[ "VisIt" ]
2f940498b336944200b1a93915d84565f19a64da0b460b6716a334c402c73ddc
# emacs: -*- mode: python; py-indent-offset: 4; indent-tabs-mode: nil -*- # vi: set ft=python sts=4 ts=4 sw=4 et: """The freesurfer module provides basic functions for interfacing with freesurfer tools. Change directory to provide relative paths for doctests >>> import os >>> filepath = os.path.dirname( os.pa...
satra/NiPypeold
nipype/interfaces/freesurfer/model.py
Python
bsd-3-clause
33,883
[ "Gaussian" ]
e1f3e1167ac2a5184be5124702f82dd832370e2b4e63605eb9729a83a8a65e33
"""pdbquery RAPD plugin""" """ This file is part of RAPD c Copyright (C) 2017, Cornell University All rights reserved. RAPD is free software: you can redistribute it and/or modify it under the terms of the GNU Affero General Public License as published by the Free Software Foundation, version 3. RAPD is distributed ...
RAPD/RAPD
src/plugins/mr/plugin.py
Python
agpl-3.0
36,161
[ "ADF" ]
fbc0b1a3c85da22f3443eafed279eb61cc17e33d4db34f5ab6fb3e604affcd52
#!/usr/bin/python # -*- coding: utf-8 -*- ################################################################################ # # RMG - Reaction Mechanism Generator # # Copyright (c) 2002-2017 Prof. William H. Green (whgreen@mit.edu), # Prof. Richard H. West (r.west@neu.edu) and the RMG Team (rmg_dev@mit.edu) # # ...
Molecular-Image-Recognition/Molecular-Image-Recognition
code/rmgpy/qm/gaussianTest.py
Python
mit
6,890
[ "Gaussian" ]
f4a0756af3b0df72d8046c2cf8bdd8ada481205f529c52c23ee417892cc765a5
# nerd font icon-name to unicode mapping icons = { "500px": "\uf26e", "accessible-icon": "\uf368", "accusoft": "\uf369", "acquisitions-incorporated": "\uf6af", "ad": "\uf641", "address-book": "\uf2b9", "address-card": "\uf2bb", "adjust": "\uf042", "adn": "\uf170", "adversal": "\u...
adamatom/dotfiles
.bin/i3_icons.py
Python
apache-2.0
34,587
[ "GULP" ]
0b6da26d9028a8f0f84118cf76fbe44aea3793afd46430de4328a5f12ed31438
"Demonstrates molecular dynamics with constant energy." from ase import * from ase.lattice.cubic import FaceCenteredCubic from ase.md.velocitydistribution import * from ase.md.verlet import * # Use Asap for a huge performance increase if it is installed useAsap = False if useAsap: from asap3 import EMT size ...
freephys/python_ase
doc/tutorials/md/moldyn1.py
Python
gpl-3.0
1,250
[ "ASE", "CRYSTAL" ]
6bcfbfc586d1c4dcc34d14fa038ec70e333e48e52ddb3554db2d0c83bb7f13be
""" Container page in Studio """ from bok_choy.page_object import PageObject from bok_choy.promise import Promise, EmptyPromise from . import BASE_URL from .utils import click_css, confirm_prompt, type_in_codemirror class ContainerPage(PageObject): """ Container page in Studio """ NAME_SELECTOR = '....
valtech-mooc/edx-platform
common/test/acceptance/pages/studio/container.py
Python
agpl-3.0
18,991
[ "VisIt" ]
14ca9fbcfc24efe3c3b20c61b5bad15f7c3756582ed466e75f11514179ab7a82
# htmlwindow-1.py # Very simple demo of HTMLWindow. from wax import * HTML = """\ <h3>HTMLWindow</h3> <p>Hello friends! This is some simple <b>HTML</b>.</p> <p>Flourish &amp; Blotts</p> <p>Also visit <a href="http://www.python.org/">www.python.org</a>!</p> """ class MainFrame(Frame): def Body(self): ...
MSMBA/msmba-workflow
msmba-workflow/srclib/wax/examples/htmlwindow-1.py
Python
gpl-2.0
579
[ "VisIt" ]
d4dce3f5ae542dcdb656c382a3a143d3c158c8a9d6bbee7aedaf3ee07657cecf
#!/usr/bin/env python """Universal feed parser Handles RSS 0.9x, RSS 1.0, RSS 2.0, CDF, Atom 0.3, and Atom 1.0 feeds Visit http://feedparser.org/ for the latest version Visit http://feedparser.org/docs/ for the latest documentation Required: Python 2.4 or later Recommended: CJKCodecs and iconv_codec <http://cjkpytho...
waseem18/oh-mainline
vendor/packages/feedparser/feedparser/feedparser.py
Python
agpl-3.0
168,065
[ "NetCDF", "VisIt" ]
0776da7067c22d625aab6e127eaf6cb1ef595acd9875a160f134480632e7e775
# lots to do: # __ native drawLines # __ add native drawCurve method # __ native rectangle/round rect method # __ native drawEllipse # __ native drawArc # __ drawImage support (work on Pyart side of things) from __future__ import print_function import pyart from rdkit.sping.pid import * from rdkit.sping...
adalke/rdkit
rdkit/sping/Pyart/pidPyart.py
Python
bsd-3-clause
9,324
[ "RDKit" ]
bdc7a5cc861adacce97c8f774ca38757f18ed483b1bf5bf6ca50418b54fefb83
from ast import Attribute, Await, Dict, Expr, NodeTransformer, parse from inspect import getsource from textwrap import dedent from typing import Any from sanic.log import logger from .base import BaseScheme class OptionalDispatchEvent(BaseScheme): ident = "ODE" def __init__(self, app) -> None: sup...
ashleysommer/sanic
sanic/touchup/schemes/ode.py
Python
mit
2,262
[ "VisIt" ]
8505fffae86fdda4ce990afc4abd835113bd10f56873b9c5ff5ada3fd2a0752a
# ***** BEGIN LICENSE BLOCK ***** # Version: MPL 1.1/GPL 2.0/LGPL 2.1 # # The contents of this file are subject to the Mozilla Public License Version # 1.1 (the "License"); you may not use this file except in compliance with # the License. You may obtain a copy of the License at # http://www.mozilla.org/MPL/ # # Softwa...
centrumholdings/buildbot
buildbot/db/dbspec.py
Python
gpl-2.0
10,328
[ "Brian" ]
2b2cc22f06e4c6df5de4342376362738f6d4bcaa880d602dc21df5bcc466f429
################################ # Author : septicmk # Date : 2015/07/23 19:20:57 # FileName : fusion.py ################################ import numpy as np import math from MEHI.utils.tool import exeTime @exeTime def content_fusion(rdd, sgm1=44, sgm2=81): ''' Usage: - a fast impleme...
septicmk/MEHI
MEHI/paralleled/fusion.py
Python
bsd-3-clause
2,378
[ "Gaussian" ]
370d3b91f1ec06582c0e29419dbe0dd61da0cf57e25f98699681d7927b904fc6
# Copyright 2014 Google Inc. All Rights Reserved. # # Licensed under the Apache License, Version 2.0 (the "License"); # you may not use this file except in compliance with the License. # You may obtain a copy of the License at # # http://www.apache.org/licenses/LICENSE-2.0 # # Unless required by applicable law or a...
pombreda/syzygy
syzygy/build/gitdeps.py
Python
apache-2.0
25,203
[ "VisIt" ]
9f711511b98206a570a4faf6bd5bb033a7a88a4ad5e836b50bd5b8ab16ce7b09
#!/usr/bin/env python # -*- coding: utf-8 -*- import pylid from collections import Counter cs = pylid.PyLID(3) cs.total_ngrams = 84202116 cs.lang = 'cs' cs.ngrams = Counter({ u'n\xed#': 669406, u'#po': 531349, u'#pr': 516175, u'ch#': 482809, u'#a#': 479692, u'pro': 378527, u'#p\u0159': 374...
dmort27/pylid
pylid/langs/cs.py
Python
mit
327,925
[ "ADF", "ASE", "BWA", "EPW", "Elk", "MOE" ]
6572aab9cd95b7219026333b54db8644f8efff46c4561263861030d1c3161f65
#------------------------------------------------------------------------------- # . File : QMCallerGAMESS.py # . Program : MolarisTools # . Copyright : USC, Mikolaj Feliks (2015-2018) # . License : GNU GPL v3.0 (http://www.gnu.org/licenses/gpl-3.0.en.html) #----------------------------------------------...
mfx9/MolarisTools
MolarisTools/QMMM/QMCallerGAMESS.py
Python
gpl-3.0
4,684
[ "GAMESS" ]
db4c6775ee1daf8d3003c24f5d0692292d80553892547d4c8a7118b5aa7420cf
#!/usr/bin/env python """ author Brian O'Connor broconno@ucsc.edu This module first queries a given Redwood instance for metadata document, downloads them, minimally transforms them, and, finally, loads them into Elasticsearch ready for querying. """ import semver import logging import os import...
briandoconnor/hca-indexing-sandbox
query_and_load.py
Python
apache-2.0
5,071
[ "Brian" ]
0163bab55f859c726cd52c689a886b89894b3e10b8d8dc3f7a7a9b72397488db
from ..nodes import CtreeNode from ..util import flatten class TemplateNode(CtreeNode): """Base class for all template nodes.""" def __init__(self, template_txt, child_dict): """ Create a new template node. :param template_txt: The template as a string. :param child_dict: A map...
alphaFred/Sejits4Fpgas
sejits4fpgas/src/vhdl_ctree/templates/nodes.py
Python
gpl-3.0
3,245
[ "VisIt" ]
a965f38ced61a3d8969e62cbd91c86a49d0e03b71865477d3b6011441bfb18c9
import data import pycuda.driver as cuda import numpy as np from pycuda._driver import MemoryError import logging import kernels from pycuda.compiler import SourceModule def run( exp, gm, sm, nm, sample_block_size, npairs_block_size, nets_block_size, rms_only=True): srt = data.SharedSampleRankTemplate( exp.buffer...
JohnCEarls/GPUDirac
gpudirac/device/dirac.py
Python
agpl-3.0
3,857
[ "DIRAC" ]
50c704061c224cbe91c9c3e798b86419fc9117485593f6d6814e63d50c867379
"""Driver for gradient calculations.""" from __future__ import print_function import six.moves.builtins as builtins import logging import time import traceback import warnings import numpy # for numeric_grad from six import itervalues from six.moves import StringIO import theano from theano import gof from theano.g...
valexandersaulys/airbnb_kaggle_contest
venv/lib/python3.4/site-packages/Theano-0.7.0-py3.4.egg/theano/gradient.py
Python
gpl-2.0
81,192
[ "VisIt" ]
c2992bf2af7b96682e94f3b82a1e3676b1b194949e27d643135be7d624284703
# GridCal # Copyright (C) 2022 Santiago Peñate Vera # # This program is free software; you can redistribute it and/or # modify it under the terms of the GNU Lesser General Public # License as published by the Free Software Foundation; either # version 3 of the License, or (at your option) any later version. # # This pr...
SanPen/GridCal
src/GridCal/Engine/Core/topology.py
Python
lgpl-3.0
6,221
[ "VisIt" ]
68a3f26f5a023f935af20ec0937566539f51b7c7e3d579273bcbb05efce37935
# c: 14.12.2007, r: 03.11.2008 import os import numpy as nm from sfepy.base.base import output, default_printer, pause, debug, Struct from sfepy.fem import MeshIO from gen_mesh import gen_concentric is_3D = False generate_2D = False fig_suffix = '.pdf' if is_3D: filename_mesh = 'database/phono/cube_sphere.mesh' #...
certik/sfepy
input/phono/band_gaps_rigid.py
Python
bsd-3-clause
13,456
[ "VTK" ]
ffba37c7e2784e06f1ed10104be35f57a630576f59acdcabde700720f2e4aee9
""" Module simplifying manipulation of XML described at http://libvirt.org/formatdomain.html """ import logging from autotest.client.shared import error from virttest import xml_utils from virttest.libvirt_xml import base, accessors, xcepts from virttest.libvirt_xml.devices import librarian class VMXMLDevices(list):...
waynesun09/virt-test
virttest/libvirt_xml/vm_xml.py
Python
gpl-2.0
49,655
[ "VisIt" ]
3368701003a5fedec6f1b5a4a97126d715842841aca9395edd3f41fa67143e9b
# Copyright (c) 2010 Howard Hughes Medical Institute. # All rights reserved. # Use is subject to Janelia Farm Research Campus Software Copyright 1.1 license terms. # http://license.janelia.org/license/jfrc_copyright_1_1.html import osg, osgDB, osgText from shape import Shape, UnitShape, PathShape import neuropti...
JaneliaSciComp/Neuroptikon
Source/display/visible.py
Python
bsd-3-clause
120,493
[ "NEURON" ]
729ac57610a3fab61bcbbde96111635385fde22b50fd628bffa5ac0d8a8e80a1
import asyncio import pickle from datetime import datetime, timedelta import json from os import path from astral import Astral, GoogleGeocoder from Firefly import logging, scheduler from Firefly.const import DAY_EVENTS, EVENT_TYPE_BROADCAST, SOURCE_LOCATION, TIME, LOCATION_FILE from Firefly.helpers.events import Eve...
Firefly-Automation/Firefly
Firefly/helpers/location.py
Python
apache-2.0
8,331
[ "Firefly" ]
bbfe340f052dde613403d01cb44b54a56b290b15a69a3015ae47ebc84d7c248d
# -*- coding: utf-8 -*- # vi:si:et:sw=4:sts=4:ts=4 ## ## Copyright (C) 2005-2007 Async Open Source <http://www.async.com.br> ## All rights reserved ## ## This program is free software; you can redistribute it and/or modify ## it under the terms of the GNU Lesser General Public License as published by ## the Free Softw...
andrebellafronte/stoq
stoqlib/gui/search/fiscalsearch.py
Python
gpl-2.0
6,159
[ "VisIt" ]
c65ed0bee31724e5a1e19976077f223d907288618d7f111f81c17c5f38f5df23
"""Test of ScaLAPACK diagonalize and inverse cholesky. The test generates a random symmetric matrix H0 and positive definite matrix S0 on a 1-by-1 BLACS grid. They are redistributed to a mprocs-by-nprocs BLACS grid, diagonalized in parallel, and eigenvalues are compared against LAPACK. Eigenvectors are not compared....
robwarm/gpaw-symm
gpaw/test/parallel/scalapack.py
Python
gpl-3.0
6,034
[ "GPAW" ]
e7a5267ff96d1e628440b394a91024a65b4b51d76def2c15839a94f2085a0992
# sql/elements.py # Copyright (C) 2005-2020 the SQLAlchemy authors and contributors # <see AUTHORS file> # # This module is part of SQLAlchemy and is released under # the MIT License: http://www.opensource.org/licenses/mit-license.php """Core SQL expression elements, including :class:`_expression.ClauseElement`, :clas...
gltn/stdm
stdm/third_party/sqlalchemy/sql/elements.py
Python
gpl-2.0
161,275
[ "VisIt" ]
63bad5cc7d36b54d40851d05830041ce328d320e54fa3c897f7f6a6c99d9b30d
#pylint: disable=missing-docstring #################################################################################################### # DO NOT MODIFY THIS HEADER # # MOOSE - Multiphysics Object Oriented Simulation Environment ...
yipenggao/moose
python/MooseDocs/common/nodes.py
Python
lgpl-2.1
20,082
[ "MOOSE" ]
12a6e376cdc816d66aa57363b7bd7723193863be53490bd4110be35665a87980
# Copyright 2016-2017 Nitor Creations Oy # # Licensed under the Apache License, Version 2.0 (the "License"); # you may not use this file except in compliance with the License. # You may obtain a copy of the License at # # http://www.apache.org/licenses/LICENSE-2.0 # # Unless required by applicable law or agreed to ...
NitorCreations/nitor-deploy-tools
n_utils/__init__.py
Python
apache-2.0
5,020
[ "CDK" ]
c07e1bef07ab747b160131eda1f8d7b517960d47346c90f323df6b73ba7a08dd
#* This file is part of the MOOSE framework #* https://www.mooseframework.org #* #* All rights reserved, see COPYRIGHT for full restrictions #* https://github.com/idaholab/moose/blob/master/COPYRIGHT #* #* Licensed under LGPL 2.1, please see LICENSE for details #* https://www.gnu.org/licenses/lgpl-2.1.html import matp...
nuclear-wizard/moose
modules/level_set/examples/vortex/area.py
Python
lgpl-2.1
1,388
[ "MOOSE" ]
f4cd2b2866d1b7e0495cc2ef3ff02ecb30b6833fab3baf81cbf8e31637f6498a
""" Results for test_glm.py. Hard-coded from R or Stata. Note that some of the remaining discrepancy vs. Stata may be because Stata uses ML by default unless you specifically ask for IRLS. """ import numpy as np from scikits.statsmodels.compatnp.py3k import asbytes import glm_test_resids import os from scikits.statsm...
wesm/statsmodels
scikits/statsmodels/genmod/tests/results/results_glm.py
Python
bsd-3-clause
270,087
[ "Gaussian" ]
5d9f8563256ef024c9e0dc0f6409915905d62e5d85010db4e302abe5f5ceb526
# ============================================================================ # # Copyright (C) 2007-2010 Conceptive Engineering bvba. All rights reserved. # www.conceptive.be / project-camelot@conceptive.be # # This file is part of the Camelot Library. # # This file may be used under the terms of the GNU General...
kurtraschke/camelot
camelot/view/workspace.py
Python
gpl-2.0
7,780
[ "VisIt" ]
293d41dce708dbf6915941c14344969d26e56b705a4f9d844a0589d4502d14cd
""" PilotCommand The PilotCommand class is a command class to know about present pilots efficiency. """ from DIRAC import S_OK, S_ERROR from DIRAC.ConfigurationSystem.Client.Helpers.Resources import getSites, getCESiteMapping from DIRAC.ResourceStatusSystem.Command.Command import Command from DIRAC.ResourceStatus...
DIRACGrid/DIRAC
src/DIRAC/ResourceStatusSystem/Command/PilotCommand.py
Python
gpl-3.0
6,080
[ "DIRAC" ]
2daa34881108ab3ce5dba91346ab879972f6cd76ebf93e6117ee555940f79245
#!/usr/bin/python import os import json import urllib import subprocess import sys url_base = "http://admin.ci.centos.org:8080" api_key = os.environ['API_KEY'] count = os.environ['MACHINE_COUNT'] if os.environ.get('MACHINE_COUNT') != None else "1" ver = "7" arch = "x86_64" req_url = "%s/Node/get?key=%s&ver=%s&arch=%s...
navidshaikh/vagrant-service-manager
.ci/jenkins-execute-script.py
Python
gpl-2.0
3,164
[ "CDK" ]
4bd16cf9fce8bb29cb1757a2a8e46650e757b32953b9374f40e046e31e88bc41
# -*- coding: utf-8 -*- """ End-to-end tests for the main LMS Dashboard (aka, Student Dashboard). """ import datetime from nose.plugins.attrib import attr from common.test.acceptance.fixtures.course import CourseFixture from common.test.acceptance.pages.common.auto_auth import AutoAuthPage from common.test.acceptance...
miptliot/edx-platform
common/test/acceptance/tests/lms/test_lms_dashboard.py
Python
agpl-3.0
14,461
[ "VisIt" ]
2541249637eedcf3ae3f1b17226e1f9b2b44d584094e4cc5c6d35b2ae37ce5a3
#!/usr/bin/env python #coding: utf-8 import json import sys import os import re import numpy as np import neuron from neuron import h from builtins import range # This is super annoying: without neuron.gui, need # to explicit load 'standard' hoc routines like 'run', # but this is chatty on stdout, which means we get ...
eth-cscs/nestmc-proto
validation/ref/neuron/nrn_validation.py
Python
bsd-3-clause
8,771
[ "NEURON" ]
8ed27dfcee0c6e630cf2a3006f95edce037f7058ac9b79e3d1628534e1924de3
# Copyright (C) 2011-2012 CRS4. # # This file is part of Seal. # # Seal 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. # # Seal is dis...
QwertyManiac/seal-cdh4
tests/seal/lib/aligner/bwa/testing_utilities.py
Python
gpl-3.0
8,921
[ "BWA", "Biopython" ]
e2d19e7bf017696c9b9908868dd9fc82556cdffb4bca0cbf60c9fe4d2f9754ee
""" K-means Clustering and Vector Quantization Module Provides routines for k-means clustering, generating code books from k-means models, and quantizing vectors by comparing them with centroids in a code book. The k-means algorithm takes as input the number of clusters to generate, k, and a set of observation vector...
jasonmccampbell/scipy-refactor
scipy/cluster/vq.py
Python
bsd-3-clause
25,832
[ "Gaussian" ]
47074512896e115a0948316b2a7f69638164eae42a94bf82ef74adf361c84e0f
# Generated by Django 1.11.2 on 2017-06-22 10:22 import bitfield.models import django.contrib.auth.models import django.core.validators import django.db.models.deletion import django.utils.timezone from django.conf import settings from django.db import migrations, models from django.db.backends.postgresql.schema import...
eeshangarg/zulip
zerver/migrations/0001_initial.py
Python
apache-2.0
35,999
[ "VisIt" ]
de18a337a304f8b2151e3c880314e943d0a10894505d0e537a6912deafa48821
"""////////////////////////////////////////////////////////////////////////////// // // // Copyright © 2016 Juan P. Dominguez-Morales // // ...
jpdominguez/Multilayer-SNN-for-audio-samples-classification-using-SpiNNaker
Main_SNN_Classifier.py
Python
gpl-3.0
8,611
[ "NEURON" ]
e8a04b0cedfd4e89e14714e563bf23455d989629981669a40823e1ef8635c756
#!/usr/bin/env python3 # ver 0.1 - copy from rdf_itf.py (v0.1) and modify codes on 2/3/2018 import argparse parser = argparse.ArgumentParser( formatter_class=argparse.ArgumentDefaultsHelpFormatter, description='calculation end-to-end distance of molecules you select') ## args parser.add_argument('-i', '--in...
jht0664/Utility_python_gromacs
python/ree.py
Python
mit
4,168
[ "MDAnalysis" ]
242b2378f88f070d1711958f3a2154ee8758f5992b962544780d91ad06a01ad0
#!/usr/bin/env python # -*- coding: utf8 -*- # ***************************************************************** # ** PTS -- Python Toolkit for working with SKIRT ** # ** © Astronomical Observatory, Ghent University ** # ***************************************************************** ##...
Stargrazer82301/CAAPR
CAAPR/CAAPR_AstroMagic/PTS/pts/modeling/preparation/preparer.py
Python
mit
21,533
[ "Galaxy" ]
78ad23b338517f3acd3423724d92ed88f2176d692e4d8180adacb344d828064e
# Copyright 2013-2020 Lawrence Livermore National Security, LLC and other # Spack Project Developers. See the top-level COPYRIGHT file for details. # # SPDX-License-Identifier: (Apache-2.0 OR MIT) from spack import * import re class Texinfo(AutotoolsPackage, GNUMirrorPackage): """Texinfo is the official documen...
iulian787/spack
var/spack/repos/builtin/packages/texinfo/package.py
Python
lgpl-2.1
2,071
[ "Brian" ]
9557b258b471f770a0323f41e62dab0113f02dd7c47ba201460e9600f069c939
""" Code for kernel density estimation. - Source: http://nbviewer.jupyter.org/gist/tillahoffmann/f844bce2ec264c1c8cb5 """ import numpy as np from scipy.spatial.distance import cdist class gaussian_kde(object): """Representation of a kernel-density estimate using Gaussian kernels. Kernel density estimation i...
DamienIrving/ocean-analysis
modules/kde.py
Python
mit
11,449
[ "Gaussian" ]
98968dc4256413e148d7ff194478e20b4da250202434f408fa2945e8fb3c3d18
# Copyright (c) 2012 The Chromium Authors. All rights reserved. # Use of this source code is governed by a BSD-style license that can be # found in the LICENSE file. """Top-level presubmit script for Chromium. See http://dev.chromium.org/developers/how-tos/depottools/presubmit-scripts for more details about the presu...
leighpauls/k2cro4
PRESUBMIT.py
Python
bsd-3-clause
29,745
[ "VisIt" ]
6469389707a86d9565dbdb2e80cb5718a42c81936fc6a2d3cb1c068bdd134fab
#!/usr/bin/python # -*- coding: utf-8 -*- # # --- BEGIN_HEADER --- # # jobobjsubmit - submit helper to submit job objects directly # Copyright (C) 2003-2009 The MiG Project lead by Brian Vinter # # This file is part of MiG. # # MiG is free software: you can redistribute it and/or modify # it under the terms of the GNU...
heromod/migrid
mig/cgi-bin/jobobjsubmit.py
Python
gpl-2.0
1,147
[ "Brian" ]
4417621e5e289ecad8a50eb4ce9e19f0c2c2c4dabe6dfab1e273437b99e374c3
# -*- coding: utf-8 -*-s import numpy as np import create_timeseries as cts #create grid manual_grid_option=True lons,lats,lonbs,latbs,nlon,nlat,nlonb,nlatb=cts.create_grid(manual_grid_option) p_full,p_half,npfull,nphalf=cts.create_pressures() #create times is_climatology=False num_years=100 time_spacing=num_years ...
jamesp/Isca
src/extra/python/scripts/create_co2_timeseries.py
Python
gpl-3.0
1,095
[ "NetCDF" ]
b81c8cdebe366f521933527281b240edab5e40cf3b758f99c2cd697725a4ad83
import optparse import numpy as np from ase.atoms import Atoms from gpaw import FermiDirac from gpaw.tasks.convergence import ConvergenceTestTask class EggboxTestTask(ConvergenceTestTask): taskname = 'eggbox' def __init__(self, **kwargs): """Calculate size of eggbox error. A single atom is...
ajylee/gpaw-rtxs
gpaw/tasks/eggbox.py
Python
gpl-3.0
1,622
[ "ASE", "GPAW" ]
a9554f15c521d698fa7e69145c8e37c3d435118e9b5bbff85f2b697a202bf465
import numpy as np from ..geometry.point import Point class DataGenerator: @staticmethod def generate_random_set(n=10, d=2, seed_value=431): #print('n={}'.format(n)) #print('d={}'.format(d)) np.random.seed(seed_value) points = np.random.rand(n, d) return np.array([Point(...
nhonaitran/aries
aries/utils/datagenerator.py
Python
gpl-2.0
700
[ "Gaussian" ]
6241eb8db41338578543dc9dacc737fc7b7c48a56490ec4d658c3ba3582f56c6
"""Handles IMAP operations for tMail, the terminal Gmail client""" import os import time from os import path from simplecrypt import decrypt, encrypt import imaplib from requests_oauthlib import OAuth2Session CLIENT_ID = '47637480825-5d3ndp33q8m6eojt015p9th1q5cig3bm.apps.googleusercontent.com' CLIENT_SECRET = 'xjFx...
nortonprojects/terMail
authentication.py
Python
lgpl-2.1
5,601
[ "VisIt" ]
25f7e34fc1ce86c12e278249d6362387982d4369ed175c8393bd65922ac9f5cb
# ---------------------------------------------------------------------------- # Copyright (c) 2013--, scikit-bio development team. # # Distributed under the terms of the Modified BSD License. # # The full license is in the file COPYING.txt, distributed with this software. # --------------------------------------------...
demis001/scikit-bio
skbio/stats/ordination/_redundancy_analysis.py
Python
bsd-3-clause
9,550
[ "scikit-bio" ]
7d988203dce790a4f117ffcba66fe95a810da1f013a1fbac5f4a601100f2a89e
# Copyright 2013-2021 Lawrence Livermore National Security, LLC and other # Spack Project Developers. See the top-level COPYRIGHT file for details. # # SPDX-License-Identifier: (Apache-2.0 OR MIT) from spack import * class RGostats(RPackage): """Tools for manipulating GO and microarrays A set of tools fo...
LLNL/spack
var/spack/repos/builtin/packages/r-gostats/package.py
Python
lgpl-2.1
1,837
[ "Bioconductor" ]
40be587b101737c3cf8a49570e92eeec4600c14a96af9583fb288d7f8a856ff4
# Copyright 2020-2021 Peppy Player peppy.player@gmail.com # # This file is part of Peppy Player. # # Peppy Player 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 you...
project-owner/Peppy
util/imageutil.py
Python
gpl-3.0
42,494
[ "Gaussian" ]
6add39883de662498ace68146da13005a1cd51d9bef36b7788d33bce1b669810
# -*- coding: utf-8 -*- # # test_status.py # # This file is part of NEST. # # Copyright (C) 2004 The NEST Initiative # # NEST 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 2 of the License, or...
steffengraber/nest-simulator
testsuite/pytests/test_status.py
Python
gpl-2.0
7,597
[ "NEURON" ]
73408e965e2c6e0ea876be0c52496a3ba59733b81a4104bb0cb026b99c3172e1
# $HeadURL: $ ''' SpaceTokenOccupancyCommand The Command gets information of the SpaceTokenOccupancy from the lcg_utils ''' import lcg_util from DIRAC import gLogger, S_OK, S_ERROR from DIRAC.Core.Utilities.Subprocess import py...
marcelovilaca/DIRAC
ResourceStatusSystem/Command/SpaceTokenOccupancyCommand.py
Python
gpl-3.0
6,123
[ "DIRAC" ]
ea55c8041c41a3eb929a5d844d96ca8946470753d7e31a79009ba3069386e838
__all__ = [ "bedtools", "bvatools", "bwa", "cufflinks", "differential_expression", "gatk", "gq_seq_utils", "htseq", "igvtools", "metrics", "mummer", "pacbio_tools", "picard", "ray", "readset", "rrna_amplicons", "run_processing_aligner" "sample", ...
ccmbioinfo/mugqic_pipelines
bfx/__init__.py
Python
lgpl-3.0
458
[ "BWA", "HTSeq" ]
0d2d1ef825c96af000330a44cf931e39428a4b24cea4120506ee2539ec81eefd
# -*- coding: utf-8 -*- # # # TheVirtualBrain-Scientific Package. This package holds all simulators, and # analysers necessary to run brain-simulations. You can use it stand alone or # in conjunction with TheVirtualBrain-Framework Package. See content of the # documentation-folder for more details. See also http://ww...
stuart-knock/tvb-library
tvb/tests/library/datatypes/patterns_test.py
Python
gpl-2.0
5,663
[ "Gaussian" ]
6d7b3fa8b092ab4ec0dd6818cac2f97a34e3f5a984af790bf75c0c54b17035a2
# # Copyright (C) 2000 greg Landrum # """ unit tests for the Neural network trainer implementation this basically works out **all** of the network code """ from __future__ import print_function import unittest from rdkit.ML.Neural.ActFuncs import Sigmoid, TanH from rdkit.ML.Neural.NetNode import NetNode from r...
rvianello/rdkit
rdkit/ML/Neural/UnitTestOther.py
Python
bsd-3-clause
2,498
[ "RDKit" ]
47392c63726cdc2c661329554c2a741d7daaabfef27b723580df75e7a31530f4
import argparse import pysam import numpy def print_sex(bam): """ Print sex based on chr x ratio Args: bam (str): Path to bam file """ idxstats = pysam.idxstats(bam) chr_ratio = [] # Calculate read / chromosome length ratio per chromosome for chr in idxstats[0:24]: chr = chr.st...
CuppenResearch/IAP
scripts/determine_sex.py
Python
mit
1,337
[ "pysam" ]
9a37f1d837eb9a4d3304c9402c8de8e4cbd9f1164a301f1fecaddf61ee3e3554
######################################################################## # # (C) 2015, Brian Coca <bcoca@ansible.com> # # This file is part of Ansible # # Ansible 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...
emersonsoftware/ansiblefork
lib/ansible/galaxy/role.py
Python
gpl-3.0
14,352
[ "Brian", "Galaxy" ]
f041eafb4184032030175ed850716ac46d960b8b60683bcf89794413e9a39ead
# Copyright 2019 The TensorFlow Authors. All Rights Reserved. # # Licensed under the Apache License, Version 2.0 (the "License"); # you may not use this file except in compliance with the License. # You may obtain a copy of the License at # # http://www.apache.org/licenses/LICENSE-2.0 # # Unless required by applica...
tensorflow/addons
tensorflow_addons/activations/gelu.py
Python
apache-2.0
2,575
[ "Gaussian" ]
80b1787c441cd59c8ee3a68f09712176a1e659bb62ca95506fa605c0790700b5
# -*- coding: utf-8 -*- # Copyright 2008-2013 Jaap Karssenberg <jaap.karssenberg@gmail.com> '''Package with source formats for pages. Each module in zim.formats should contains exactly one subclass of DumperClass and exactly one subclass of ParserClass (optional for export formats). These can be loaded by L{get_pars...
hjq300/zim-wiki
zim/formats/__init__.py
Python
gpl-2.0
47,634
[ "VisIt" ]
424c74eeae4e7ddf88179f90e99a3cba9f42e26874bfe248d7c90860a8cc975f
# -*- coding: utf-8 -*- """ zine.plugins.eric_the_fish.fortunes ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~ Erics fortune cookies (ripped and stripped from the ubuntu `fortune` fortune data file.) :copyright: (c) 2010 by the Zine Team, see AUTHORS for more details. :license: BSD, see LICENSE for more ...
mitsuhiko/zine
external-plugins/eric_the_fish/fortunes.py
Python
bsd-3-clause
20,673
[ "VisIt", "exciting" ]
539e5deebc76041f623e66547016bcc26fb1fa93032035ca91ef7cd3a55fc2ca
#!/usr/bin/python #------------------------------------------------------------------------------ # Name: getThresh.py # Author: Ra Inta, 20150716 # Last Modified: 20150716 # This is a pared down version of lookThresh.py. This is used to give # an estimate of the (1-alpha confidence) 2F threshold fo...
NotAFakeRa/Front_end_CW_searches
getThresh.py
Python
mit
3,741
[ "Gaussian" ]
02c8d71cb009080f5431970bc47dedc06d62a53a1745497eadbd583cc6a7993e
#!/usr/local/bin/python # coding: utf-8 ''' PocketPidge.py - Produce PDF pocket diaries for users. ''' import datetime from reportlab.pdfgen.canvas import Canvas from reportlab.lib.pagesizes import A4 from reportlab.lib.styles import getSampleStyleSheet, ParagraphStyle from reportlab.lib.enums import TA_JUSTIFY, TA_C...
fergusrossferrier/mypidge.com
MyPidge/PocketPidge.py
Python
agpl-3.0
30,632
[ "VisIt" ]
9cabbf7f9ef33f9d88e05feb8703aac0ec5849ac910cbe7ea53ec575a270c257
# -*- coding: utf-8 -*- import shutil import tempfile import os import optparse import traceback import re import threading import time from io import open from lwr.lwr_client import submit_job from lwr.lwr_client import finish_job from lwr.lwr_client import LwrOutputs from lwr.lwr_client import ClientOutputs from lwr...
jmchilton/lwr
test/check.py
Python
apache-2.0
15,187
[ "BWA", "Galaxy" ]
cbda052e219566927e4d7cf87c966ff448fb7823fac2cfe5027f984b21c49c75
# ------------------------------------------------------------------------- # Copyright (c) Microsoft Corporation. All rights reserved. # Licensed under the MIT License. See License.txt in the project root for # license information. # -------------------------------------------------------------------------- import lo...
Azure/azure-sdk-for-python
sdk/storage/azure-storage-queue/azure/storage/queue/_shared/authentication.py
Python
mit
5,369
[ "VisIt" ]
60f87e28954c535682e41b8e7e232322ebac5ab494d05c18457ca6999f843f9b
""" FitPanel class contains fields allowing to display results when fitting a model and one data """ import sys import wx import wx.lib.newevent import numpy as np import copy import math import time import traceback from sasmodels.weights import MODELS as POLYDISPERSITY_MODELS from sas.sasgui.guiframe.event...
lewisodriscoll/sasview
src/sas/sasgui/perspectives/fitting/fitpage.py
Python
bsd-3-clause
129,061
[ "Gaussian" ]
04d3c1cfa55eded8d7edbd7e97451749691bc325c876bcfaaef9eceef4e53539
# -*- coding: utf-8 -*- from __future__ import unicode_literals from django.db import models, migrations import uuid class Migration(migrations.Migration): dependencies = [ ('visit', '0037_visit_key'), ] operations = [ migrations.AlterField( model_name='visit', n...
koebbe/homeworks
visit/migrations/0038_auto_20150722_2116.py
Python
mit
433
[ "VisIt" ]
3aa883eae7f78056b77b8f4014affa3bf963866a26f1695053053cbee23de18f
# prepare_receptors.py # Create the .pdbqt files and receptors coordinates file of receptors # for VinaMPI Docking # Usage: # python prepare_receptors.py # # Specify the correct paths of prepare_receptor4.py pythonsh VMD # Make sure the get_AS_grid.tcl file uses the correct residue number # of the active sites # Run th...
Xiaofei-Zhang/NAMD_Docking_pipeline
pre_DOCKING/prepare_receptors.py
Python
mit
1,588
[ "VMD" ]
f323b1142ed131671bab751f5e483d65892b20a755fb07ecd16edd83fd2fb211
#!/usr/bin/env python import numpy import subprocess import vtk import matplotlib matplotlib.use('Agg') import matplotlib.pyplot as plt class fluid: def __init__(self, name = 'unnamed'): ''' A Navier-Stokes two-dimensional fluid flow simulation object. Most simulation values are assigned ...
anders-dc/ns2dfd
ns2dfd.py
Python
gpl-3.0
14,344
[ "ParaView", "VTK" ]
851bfa37276b7442b45f267b0d49db132e4fec835cb68e6b2f8223f2d5633593
# Determines perovskite structures: classifies by vacancy and substitutional defects (impurities) # Author: Evgeny Blokhin import math import random import six from ase.data import chemical_symbols from ase.data import covalent_radii from ase.spacegroup import crystal from tilde.core.constants import Perovskite_Str...
tilde-lab/tilde
tilde/classifiers/perovskites.py
Python
mit
6,214
[ "ASE", "CRYSTAL" ]
7445ca7a88d612baea79266224c4f31dc770fde57e22af68c4736b2b3d4d6f7a
""" This version of the code runs a swarm of simulations of various viscosities and temperatures per viscosity. Since 5-29, it also includes an adiabatic temperature variance at the LAB. All quantities are scaled using option B in Cian_RaNotes.pdf until they are written out.""" import math import os import errno from s...
Johnson-A/UNM_Research
mantle_simulation/mantle_3d_no_advection.py
Python
mit
8,674
[ "ParaView" ]
56df94c49ca3b077fcd9994d9b15550448801fb2aee5b86acd8edff252f43a01
import os import pymc import pymbar import dipoles import numpy as np import pandas as pd import simtk.openmm.app as app import simtk.openmm as mm import simtk.unit as u import mdtraj as md n_molecules = 500 traj = md.load("./dipoles.pdb") out_dir = os.path.join(os.getenv("HOME"), "dat", "dipoles") q0 = pymc.Uniform...
kyleabeauchamp/DBayes
dbayes/simulate/simulate_dipoles.py
Python
gpl-2.0
1,151
[ "MDTraj", "OpenMM" ]
1d5617a67f8bee2e87b47b2dcfaba47b3eecd1aecea8627842a4eb5664acf85e
# coding: utf-8 # Copyright (c) Pymatgen Development Team. # Distributed under the terms of the MIT License. """ This module provides classes to define everything related to band structures. """ import collections import itertools import math import re import warnings import numpy as np from monty.json import MSONab...
richardtran415/pymatgen
pymatgen/electronic_structure/bandstructure.py
Python
mit
45,088
[ "CRYSTAL", "pymatgen" ]
f538ca024a3d2ee37b95ad53e51a63198c1d0426b89753afb97e32c4a87c7cbb
import unittest import numpy as np import pysal import pysal.spreg as EC from scipy import sparse PEGP = pysal.examples.get_path class TestBaseOLS(unittest.TestCase): def setUp(self): db = pysal.open(PEGP('columbus.dbf'),'r') y = np.array(db.by_col("HOVAL")) self.y = np.reshape(y, (49,1)) ...
AlanZatarain/pysal
pysal/spreg/tests/test_ols_sparse.py
Python
bsd-3-clause
5,118
[ "COLUMBUS" ]
54dbad4fc63fd5f4abec2d367401fea6ec3b1c1265a6aa84140c92c48e632a08
from sys import exit from random import randint class Scene(object): def enter(self): print "This scene is not yet configured. Subclass it and implement enter()." exit(1) class Engine(object): def __init__(self, scene_map): self.scene_map = scene_map def play(self): current_scene = self.scene_...
amolborcar/learnpythonthehardway
ex43.py
Python
mit
7,999
[ "BLAST" ]
57443ef0a15a140551c90fb7df29ebd693da8d0f90054e18a45004006e298779
######################################################################## # File : CSCLI.py # Author : Adria Casajus ######################################################################## import sys import types import atexit import os import readline from DIRAC import gLogger from DIRAC.Core.Utilities.File impor...
andresailer/DIRAC
ConfigurationSystem/Client/CSCLI.py
Python
gpl-3.0
16,811
[ "DIRAC" ]
2cdfe70a6ad704a035eb968089682c3d151bd12f379a89de82399797cd6e491d
from os.path import join from os.path import relpath from re import compile from contextlib import contextmanager from ..staging import COMMAND_VERSION_FILENAME from ..action_mapper import FileActionMapper from logging import getLogger log = getLogger(__name__) # All output files marked with from_work_dir attribute...
jmchilton/lwr
lwr/lwr_client/staging/down.py
Python
apache-2.0
7,030
[ "Galaxy" ]
c2d2e354a70fe9af8c7d8d91bbff8ae14dc153f040baa2bffe539ef7b98a46cc