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# Copyright (c) 2015 James Hensman # Licensed under the BSD 3-clause license (see LICENSE.txt) import numpy as np from ..core import GP from . import GPLVM from .. import mappings class BCGPLVM(GPLVM): """ Back constrained Gaussian Process Latent Variable Model :param Y: observed data :type Y: np.n...
SheffieldML/GPy
GPy/models/bcgplvm.py
Python
bsd-3-clause
1,475
[ "Gaussian" ]
35a0932fbb41ded2bbfb71ee578b00cb78455ba132b6ca022a73a3f02721f3ae
""" WhatsUP: astronomical object suggestions for Las Cumbres Observatory Global Telescope Network Copyright (C) 2014-2015 LCOGT models.py - Database schemas 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 Found...
LCOGT/whatsup
whatsup/models.py
Python
gpl-3.0
3,519
[ "Galaxy" ]
4a56054b099592100f24ce0d63fbc4176535f27a9205d92f0d909fbb0ff52438
"""Reproduce by simulation of PCA estimation using wheelerdata""" import sys, os import numpy as np from numpy.random import RandomState import argparse import json from sklearn.decomposition import PCA from simfMRI.noise import white from wheelerdata.load.meta import get_data from fmrilearn.analysis import fir fro...
parenthetical-e/wheelerexp
meta/reproduce_pca.py
Python
bsd-2-clause
5,081
[ "Gaussian" ]
41b3a71409acfe2ed956dbbf23e547452149f5aad611360790f27dca20209cb5
# -*- coding: utf-8 -*- # # Magic-Wormhole documentation build configuration file, created by # sphinx-quickstart on Sun Nov 12 10:24:09 2017. # # This file is execfile()d with the current directory set to its # containing dir. # # Note that not all possible configuration values are present in this # autogenerated file...
warner/magic-wormhole
docs/conf.py
Python
mit
5,669
[ "Brian" ]
a4b0055054bb275f2823d52a681cc742992f71ac7a7500f5fa125d83545586fc
# This file is part of PyEMMA. # # Copyright (c) 2015, 2014 Computational Molecular Biology Group, Freie Universitaet Berlin (GER) # # PyEMMA 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 vers...
markovmodel/PyEMMA
pyemma/coordinates/tests/test_api_source.py
Python
lgpl-3.0
9,871
[ "NetCDF" ]
e16f2a078e7bf531f87363e4070b4872383754ad6d8404bbddc27424e48cb355
# $Id$ # # Copyright (C) 2003-2006 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 ...
rdkit/rdkit-orig
rdkit/Chem/Suppliers/UnitTestSmilesMolSupplier.py
Python
bsd-3-clause
3,020
[ "RDKit" ]
8c72f964cf8c2b0e8e180438e0de9d466dc1229cbf7438df92a5f0cfad33b9d1
from enum import Enum from itertools import product from psi4 import core from psi4.driver import psifiles as psif import numpy as np from qcelemental.util import which_import class RemovalPolicy(Enum): LargestError = 1 OldestAdded = 2 class StoragePolicy(Enum): InCore = 1 OnDisk = 2 def axpy(y, al...
psi4/psi4
psi4/driver/procrouting/diis.py
Python
lgpl-3.0
17,437
[ "Psi4" ]
4385c948926ae906a49cbb0cc504c2d430e0b72ab51ba64133afe6f2a5104c5b
############################################################################## # Copyright (c) 2013-2017, 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...
lgarren/spack
var/spack/repos/builtin/packages/r-affycomp/package.py
Python
lgpl-2.1
1,773
[ "Bioconductor" ]
518fd0dbb7be874494140a72ac5914d412a51d120b415f543e9468b9a4f6dfaa
""" vtk - surface and countours """ import enaml from enaml.qt.qt_application import QtApplication def run(): with enaml.imports(): from vtk_canvas_views import Main app = QtApplication() view = Main(custom_title='VTK Demo Example') view.show() # Start the application event loop ap...
viz4biz/PyDataNYC2015
tutorial/vtk_canvas_views_run.py
Python
apache-2.0
338
[ "VTK" ]
56c326f936789e77a8964e6ba9cd01e425a63de55f428391db7e08d10560ad9e
################################################################ # SQUAD - superconducting quantum dot # # Copyright (C) 2012-2019 Vladislav Pokorny; pokornyv@fzu.cz # # homepage: github.com/pokornyv/SQUAD # # config_squad.py - config and global variables ...
pokornyv/josephson
config_squad.py
Python
mit
5,659
[ "DIRAC" ]
c4f88335aef495d5d6adef6c975feaa743dcf95d709d3b1429972ac049ea82af
# $HeadURL$ __RCSID__ = "$Id$" from DIRAC.AccountingSystem.Client.Types.BaseAccountingType import BaseAccountingType import DIRAC class Job( BaseAccountingType ): def __init__( self ): BaseAccountingType.__init__( self ) self.definitionKeyFields = [ ( 'User', 'VARCHAR(32)' ), ...
Sbalbp/DIRAC
AccountingSystem/Client/Types/Job.py
Python
gpl-3.0
2,736
[ "DIRAC" ]
4030219ebfa0c287fddafc08461f27d8b778ed345b4cc73bb8e5956db57db449
from dataclasses import dataclass from typing import Iterator, TypeVar, Union from blib2to3.pytree import Node, Leaf, type_repr from blib2to3.pgen2 import token from black.nodes import Visitor from black.output import out from black.parsing import lib2to3_parse LN = Union[Leaf, Node] T = TypeVar("T") @dataclass cl...
psf/black
src/black/debug.py
Python
mit
1,595
[ "VisIt" ]
05b945f4bf3c84d19bb95a3e107e92cc7a398e005b160587c8b2f5e338653b76
#!/usr/bin/python import getopt import sys from Bio import SeqIO from Bio.SeqUtils import GC import time# import time, gmtime, strftime import os import shutil import pandas from Bio.SeqRecord import SeqRecord from Bio.Seq import Seq import csv #from datetime import datetime import numpy as np from scipy import stats ...
nyirock/mg_blast_wrapper
mg_xwrapser_latest.py
Python
mit
26,958
[ "BLAST" ]
0a51ab19dcb4ec9412f0833dea526a616c7ec895ecfdfc565214595a1c6c8097
from rest_framework.authentication import SessionAuthentication, BasicAuthentication from rest_framework_jwt.authentication import JSONWebTokenAuthentication from rest_framework.permissions import IsAuthenticated from rest_framework import viewsets from .models import Vault, Recent from .serializers import VaultSeriali...
pyprism/Hiren-Vault
password/views.py
Python
mit
6,310
[ "VisIt" ]
9b9fcb377c4a64f8648e46c12ea1bde03294d49ff1341f934d00ba66d6373c6b
# This file is part of cclib (http://cclib.github.io), a library for parsing # and interpreting the results of computational chemistry packages. # # Copyright (C) 2006,2007,2012,2014,2015, the cclib development team # # The library is free software, distributed under the terms of # the GNU Lesser General Public v...
jchodera/cclib
test/data/testSPun.py
Python
lgpl-2.1
5,462
[ "Jaguar", "Molpro", "ORCA", "cclib" ]
e8ecff0add3828c5b4e26083aefee2d1fb1d13f475fa13935edaceb534a9e2d5
# coding: utf-8 # Copyright (c) Pymatgen Development Team. # Distributed under the terms of the MIT License. import unittest from pymatgen.util.testing import PymatgenTest from pymatgen.transformations.defect_transformations import \ DefectTransformation from pymatgen.analysis.defects.core import Vacancy class ...
mbkumar/pymatgen
pymatgen/transformations/tests/test_defect_transformations.py
Python
mit
1,327
[ "pymatgen" ]
cd2f7c5eee5c909086a75bbf04560b48b4ce85dd6cefa202d5629b912863d3d1
# This module provides classes that represent VRML objects for use # in data visualization applications. # # Written by: Konrad Hinsen <hinsen@cnrs-orleans.fr> # With contributions from Frank Horowitz <frank@ned.dem.csiro.au> # Last revision: 2004-7-19 # """This module provides definitions of simple 3D graphics object...
OS2World/DEV-PYTHON-UTIL-ScientificPython
src/Lib/site-packages/Scientific/Visualization/VRML2.py
Python
isc
21,701
[ "VMD" ]
8875a10ee8c5010f26b9903d4599c70fc64b76400e41eb8372f200783b351a19
# # Test the multipole transformation rules # import sys from math import exp, sqrt, sin, cos, pi from cmath import exp as cexp import random import numpy as np import ase from hotbit.coulomb.multipole import zero_moments, get_moments from _hotbit import multipole_to_multipole, multipole_to_local, local_to_local,...
pekkosk/hotbit
hotbit/test/multipole_operations.py
Python
gpl-2.0
5,584
[ "ASE" ]
cc30ba3117e6ae3b27758082b17185f36adeeb96cbb4187ea1823889fd103de6
""" This module contains unit tests for the theano autocorrelation function """ import unittest import numpy as np from mjhmc.misc.autocor import autocorrelation, slow_autocorrelation, sample_to_df from mjhmc.misc.distributions import Gaussian, MultimodalGaussian from mjhmc.samplers.markov_jump_hmc import MarkovJump...
rueberger/MJHMC
mjhmc/tests/test_fast_ac.py
Python
gpl-2.0
2,761
[ "Gaussian" ]
0dbfa86f2ba0c024c84d6023167a0867383450179db851fec163e3044c3a4ec5
# -*- coding: utf-8 -*- # @Author: Zachary Priddy # @Date: 2016-12-24 12:39:45 # @Last Modified by: Zachary Priddy # @Last Modified time: 2016-12-24 20:34:28 import difflib import json import logging import requests from core import ffCommand from core.database.device_db import getDeviceList from core.database.ro...
zpriddy/Firefly
Firefly/core/api/ha_bridge.py
Python
apache-2.0
3,051
[ "Firefly" ]
98ff8307f665dea81cd1c2cd781c56a41064a761aacbd742c5ce76d5d25c626e
#!/usr/bin/python # # Copyright 2015 John Kendrick # # This file is part of PDielec # # This program is free software; you can redistribute it and/or modify # it under the terms of the MIT License # # This program is distributed in the hope that it will be useful, # but WITHOUT ANY WARRANTY; without even the implied wa...
JohnKendrick/PDielec
PDielec/Utilities.py
Python
mit
9,784
[ "ABINIT", "CASTEP", "CRYSTAL", "GULP", "VASP", "phonopy" ]
bddbd34967f95d01bd334c3cbdea539f54d0df913ecf573f4712c63863c6e171
WORDS = ( 'Smith', 'Johnson', 'Williams', 'Brown', 'Jones', 'Miller', 'Davis', 'Garcia', 'Rodriguez', 'Wilson', 'Martinez', 'Anderson', 'Taylor', 'Thomas', 'Hernandez', 'Moore', 'Martin', 'Jackson', 'Thompson', 'White', 'Lopez', 'Lee', 'Gonzalez', 'Harris', 'Clark', 'Lewis', 'Robinson', 'Wal...
geradcoles/random-name
randomname/lists/surnames_american.py
Python
apache-2.0
44,764
[ "Dalton", "MOE" ]
2540284e7c1128eabb3b5ebb267b25c1649fc56aa80d2b90f9a6ecaa4e7b9890
# Copyright 2010-2017, The University of Melbourne # Copyright 2010-2017, Brian May # # This file is part of Karaage. # # Karaage 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...
brianmay/karaage
karaage/common/models.py
Python
gpl-3.0
4,374
[ "Brian" ]
e7594792239fbbcbf381acbbc7631088964b5c21a1046d0bcaccf4748fc64cb0
import numpy as np from .base import classifier from .base import regressor from numpy import asarray as arr from numpy import asmatrix as mat ################################################################################ ## KNNCLASSIFY ################################################################# ############...
sameersingh/ml-discussions
week9/mltools/knn.py
Python
apache-2.0
9,133
[ "Gaussian" ]
2847c6a96b44c36ec0026ef843966ada9dd42b65593ce0296cc4684e6ff8d6db
''' Author information. This is an extension to the Utils class from Allen Brain API. The parallel wiring related functions are written by Russell Jarvis rjjarvis@asu.edu ''' import logging import glob from mpi4py import MPI import numpy as np import logging from copy import deepcopy logger = logging.getLogger() log...
russelljjarvis/neurogateway
utils.py
Python
gpl-3.0
40,897
[ "NEURON" ]
12f6575df386aeec2472b32899bdd03a7eff85837638ce513d5abd4881988b32
# coding: utf-8 # Distributed under the terms of the MIT License. from .model import AppModel from ababe.stru.scaffold import ModifiedCell from ababe.stru.element import Specie from ababe.io.io import GeneralIO import os import numpy as np class App(AppModel): def __init__(self, infile, radius): gcell = ...
unkcpz/ababe
ababe/cmdline/apps/atomperturb.py
Python
mit
854
[ "MCell", "VASP" ]
fc6f52b653bdf2c35ab7de7c1f9e064bbd448797dcd802c0c0448631d63c2cd0
from __future__ import absolute_import # #START_LICENSE########################################################### # # # This file is part of the Environment for Tree Exploration program # (ETE). http://etetoolkit.org # # ETE is free software: you can redistribute it and/or modify it # under the terms of the GNU Gener...
karrtikr/ete
ete3/phylo/reconciliation.py
Python
gpl-3.0
8,169
[ "VisIt" ]
4ee78de4848634c0d3da590a5a0a2fde973182ce2199e827132c3fd5f79afca4
W, B = 1, 0 def fill_enclosed(grid): reached = set() for r, row in enumerate(grid): for c, col in enumerate(row): if r in (0, len(grid) - 1) or c in (0, len(grid[0]) - 1) and col == W and (r, c) not in reached: visit(grid, r, c, reached) # go through the matrix, for all...
misscindy/Interview
Graph/19_03_enclosed_region.py
Python
cc0-1.0
1,326
[ "VisIt" ]
b0c0f2aeac3c31be3c3818e19da6ba83488d1b0c1a828d3b8f3f2158fb5dd684
"""Galaxy (ansible-galaxy) plugin for integration tests.""" from __future__ import (absolute_import, division, print_function) __metaclass__ = type import os import tempfile from . import ( CloudProvider, CloudEnvironment, CloudEnvironmentConfig, ) from ..util import ( find_executable, display, )...
agaffney/ansible
test/lib/ansible_test/_internal/cloud/galaxy.py
Python
gpl-3.0
9,011
[ "Galaxy" ]
e56e64cf71408e05665f1db2fbcb2322f539416690ae94093b9e3d846c802def
""" Tests GeoTsRepositoryCollection """ from __future__ import print_function from __future__ import absolute_import from os import path # import random import unittest # import numpy as np from shyft import api from shyft import shyftdata_dir from shyft.repository.geo_ts_repository_collection import GeoTsRepositoryC...
felixmatt/shyft
shyft/tests/test_geo_ts_repository_collection.py
Python
lgpl-3.0
5,798
[ "NetCDF" ]
29f44b47dfe48ea1d26d155fae00aa5d65268b22e9513fc77a901b23f886e7f5
# -*- coding: utf-8 -*- # # Author: Sam Rushing <rushing@nightmare.com> # # Copyright (C) 2013 Alexander Shorin # All rights reserved. # # This software is licensed as described in the file COPYING, which # you should have received as part of this distribution. # """ .. module:: astm.asynclib :synopsis: Forked vers...
eddiep1101/python-astm
build/lib/astm/asynclib.py
Python
bsd-3-clause
32,188
[ "Amber" ]
9d66837527c5dd05f3b22bd0fd7152f99005b0e4806fe1ddc94484715b47d3f5
# Configuration file for the Sphinx documentation builder. # # This file only contains a selection of the most common options. For a full # list see the documentation: # http://www.sphinx-doc.org/en/master/config # -- Path setup -------------------------------------------------------------- # If extensions (or module...
PaloAltoNetworks-BD/ansible-pan
docs/conf.py
Python
isc
2,088
[ "Galaxy" ]
216e44a1be2501ec67a2339b6c5eed98aa6cb0d1f226959923893ae445d98765
''' Script to mosaic TopoWx tiles into single CONUS-wide netCDF files ''' from twx.interp import TileMosaic from twx.utils import TwxConfig, mkdir_p import fnmatch import numpy as np import os if __name__ == '__main__': np.seterr(all='raise') np.seterr(under='ignore') twx_cfg = TwxConfig(os.getenv(...
jaredwo/topowx
scripts/step26_mosaic_tiles.py
Python
gpl-3.0
1,767
[ "NetCDF" ]
f91c9f2a6206474e0e977a03462b43599f38dd032c74952b8a22c4dd404a54ec
"""setuptools.command.bdist_egg Build .egg distributions""" # This module should be kept compatible with Python 2.3 import sys, os, marshal from setuptools import Command from distutils.dir_util import remove_tree, mkpath try: from distutils.sysconfig import get_python_version, get_python_lib except Imp...
diego-d5000/MisValesMd
env/lib/python2.7/site-packages/distribute-0.6.24-py2.7.egg/setuptools/command/bdist_egg.py
Python
mit
18,884
[ "VisIt" ]
d60c7b14414aba0bb640c889a45d6e0b208b751fd64b3bb1bcf8bb5d809f93c3
# -*- coding: utf-8 -*- """ jinja2.meta ~~~~~~~~~~~ This module implements various functions that exposes information about templates that might be interesting for various kinds of applications. :copyright: (c) 2010 by the Jinja Team, see AUTHORS for more details. :license: BSD, see L...
fancasy/final
lib/jinja2/meta.py
Python
apache-2.0
4,301
[ "VisIt" ]
451412f982c4da29e088a58dac0733016b6f6c205f0bd23fcd9a178c59f48825
#!/usr/bin/python import pylab import sys import argparse import numpy as np import matplotlib.pyplot as plt import readpng as rpng import tikhonov as tik import scipy.sparse.linalg import time def create_data_and_designmatrix(img,N=500,width=10,p=1.0,deltaa=None,ixrand=None,iyrand=None,Mx=None,My=None): if Mx is ...
HajimeKawahara/pinvprob
pinvprob/random_light.py
Python
gpl-2.0
7,271
[ "Gaussian" ]
4c43d7ba17f93f624b3d408479ab806a288f9fc56128f90967199e1b150f42d3
# -*- coding: utf-8 -*- #!/usr/bin/env python # # Gramps - a GTK+/GNOME based genealogy program # # Copyright (C) 2000-2007 Donald N. Allingham # Copyright (C) 2007 Johan Gonqvist <johan.gronqvist@gmail.com> # Copyright (C) 2007-2009 Gary Burton <gary.burton@zen.co.uk> # Copyright (C) 2007-2009 Stephane Charet...
Nick-Hall/gramps
gramps/plugins/webreport/narrativeweb.py
Python
gpl-2.0
129,918
[ "Brian" ]
d95cdd3c228857437be314ef69d53704b32b4c0285964ae9f214788e393f6ec0
# Copyright (C) 2016 Collin Capano, Christopher M. Biwer, Alex Nitz # 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. # #...
cdcapano/pycbc
pycbc/distributions/__init__.py
Python
gpl-3.0
8,988
[ "Gaussian" ]
e64199c1b32b7a592e604ed01ad0bdd69d97d475b6672b9bd9ee991b0e741896
# -*- coding: utf-8 -*- from __future__ import print_function import random import time from numpy import random as nprand import moose def make_network(): size = 1024 timestep = 0.2 runtime = 100.0 delayMin = timestep delayMax = 4 weightMax = 0.02 Vmax = 1.0 thresh = 0.2 tau = 1 # Range of tau tau0 = 0.5...
upibhalla/moose-core
tests/python/mpi/recurrentIntFire.py
Python
gpl-3.0
2,839
[ "MOOSE", "NEURON" ]
2bca83131ffe565ceb6da18f5a7bca7dd640e813f03649b06789c2fcf064c731
""" Support for managing apps (as created with "0install add"). @since: 1.9 """ # Copyright (C) 2012, Thomas Leonard # See the README file for details, or visit http://0install.net. from zeroinstall import _, SafeException, logger from zeroinstall.support import basedir, portable_rename from zeroinstall.injector impo...
dabrahams/0install
zeroinstall/apps.py
Python
lgpl-2.1
13,519
[ "VisIt" ]
98ab00a9ba97cd523970f0b7463d276f248cd2efdec73277c13dc5195bcdb4e6
#! /usr/bin/env python # -*- coding: utf-8 -*- """A visitor that pauses the print at a layer """ from gcodeutils.visit.visitor import GCodeVisitor __author__ = "wireddown" PAUSE_COMMAND = "M226" class PauseAtLayer(GCodeVisitor): """This class inserts a pause command at the start of each layer specified """...
zeograd/gcodeutils
gcodeutils/visit/pause_at_layer.py
Python
gpl-2.0
1,005
[ "VisIt" ]
b6311dac738616605e64a073a553c0281c529045c3f168af9d105cb5dd9b04d1
from django.db import connection from django.db.models import Sum, Q from datetime import date, timedelta from . import TemplateFileReport, register_report REPORT_TYPE = 'clinic' TEMPLATE_DIR = 'tracking/reports/clinic' class ClinicReport(TemplateFileReport): ''' Base class for Email Reports''' def __init__...
Heteroskedastic/Dr-referral-tracker
tracking/reports/clinic_reports.py
Python
mit
8,655
[ "VisIt" ]
91d6a641ad39a13fe1cd4560497d581f2ec5487f33a7f723254c33380a725b3a
#!/usr/bin/env python #============================================================================= # # Gradient Noise Generation # # TODO: # # Add a more intelligent noise filter that is aware of the number of samples # needed between the gradient positions, and expands the filter envelope to # more evenly (Gau...
zhester/hzpy
development/gradnoise.py
Python
bsd-2-clause
8,891
[ "Gaussian" ]
9d53781c1116910f6788fc59d48268c90fa2f4beba5ee9fc7d65a4f73304d8d6
# -*- coding: utf-8 -*- """ Enrich BEL graphs ================= In the current build it is possible to enrich BEL graphs containing metabolites with associated disease or protein information and to enrich BEL graphs containing disease or protein information with associated metabolites. This can be done with the functi...
bio2bel/hmdb
src/bio2bel_hmdb/enrich.py
Python
mit
9,194
[ "Pybel" ]
2d1e184f9f8a20d840edfb5244d7faeebe831757b0a8b495f81539619315a28f
#!/usr/bin/env python """ Simple little script that allows one to automatically update DNS records through Fastmail's GUI. I could not find an official API, so this relies on beautiful soup to naviagate through fastmail's HTML pages. """ import requests, re, os, sys import json from bs4 import BeautifulSoup FASTMAIL...
ZachAnders/ddfastmail
ddfastmail.py
Python
bsd-3-clause
8,377
[ "ASE" ]
467455bc8671cf6d7a5176dca82334caadb066eb7339e2e66ab690964d76d0a9
import re from collections import defaultdict, namedtuple from datetime import datetime, timedelta from dateutil.parser import parse as dt_parse from hashlib import md5 from optparse import make_option from user_agents import parse from django.conf import settings from django.core.management.base import BaseCommand ...
analytehealth/django-analytics
djanalytics/management/commands/collect_reporting_stats.py
Python
bsd-2-clause
15,156
[ "VisIt" ]
74e96b383a680243c6272913845209f74cd654e3932eda50b651f4fe4bedcdbf
#!/usr/bin/python from scipy.stats import cauchy import random import math import csv import numpy as np #import netCDF4 as nc import argparse #import matplotlib.pyplot as plt #from mpl_toolkits.mplot3d import Axes3D #import plotly.plotly as py #import plotly.graph_objs as go ########################################...
WillArmentrout/galSims
simulate/old/Simulate_Draft_ChangeArmPositions_6.5.18.py
Python
gpl-2.0
22,890
[ "Galaxy", "Gaussian" ]
0ecbd341466ff0c57fe0d38dd653c134c875f2e1068a7ac86c1c45d10bb4741f
# # Copyright (C) 2013-2019 The ESPResSo project # # This file is part of ESPResSo. # # ESPResSo 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...
espressomd/espresso
testsuite/python/ibm.py
Python
gpl-3.0
9,741
[ "ESPResSo" ]
dee9bee47fb42885ab3bca7f83d74a2f5889734344f13e5ce92bec51a9c0d720
# -*- coding: utf-8 -*- from __future__ import unicode_literals import os from django.db import models, migrations from django.contrib.staticfiles.finders import find from django.core.files import File DEFAULT_ICON = ('default.jpg', 'Default') ICON_CHOICES = ( DEFAULT_ICON, ('blake.jpg', 'Blake'), ('joh...
simpleenergy/bughouse-ranking
bughouse/migrations/0003_auto_20150207_1846.py
Python
mit
1,458
[ "Brian" ]
2830706a18fa9d081278e6a9b7c04861dee71e38933483ef6af137883bce559e
# -*- coding: utf-8 -*- # Frozen Gaussian and quantum trajectories # The GWPs is used to approximate the amplitude instead of the wavefunction # Quantum force is computed from the approximated amplitude # A problem is that the quantum force obtained from the approximate amplitude is not accurate at the tail #i...
binghongcha08/pyQMD
GWP/QTGB/Amplitude_GWP/gwp.py
Python
gpl-3.0
16,058
[ "Gaussian" ]
e49dcdd167a38294214907475ccc4441a4f9b479bf0056627e97149c866b8fe5
from __future__ import unicode_literals import io import re import ast from .exceptions import MoultScannerError from .compat import str_ from . import utils, log _fallback_re = re.compile(r''' ^[\ \t]*( from[\ \t]+[\w\.]+[\ \t]+import\s+\([\s\w,]+\)| from[\ \t]+[\w\.]+[\ \t]+import[\ \t\w,]+| ...
tweekmonster/moult
moult/ast_scanner.py
Python
mit
11,216
[ "VisIt" ]
c4947cb82b2cabdcc88ebce1e25a55d23f32677dd8c47b55575dd0ce3121c0d7
""" Common 2D and 3D plot, quiver, text functions 2013 (BSD-3) California Institute of Technology """ from __future__ import division from warnings import warn #import numpy as np from matplotlib import pyplot as plt from vectorized_meshgrid import vec2meshgrid def dimension(ndarray): """dimension of ndarray ...
johnyf/pyvectorized
pyvectorized/multidim_plot.py
Python
bsd-3-clause
5,949
[ "Mayavi" ]
569691bc33e6ee229dd5987cf70e288e1b7c0017a4e5bf74e0b44b283e89de54
#!/usr/bin/env python # # This file is part of Buildbot. Buildbot 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, version 2. # # This program is distributed in the hope that it will be useful, but WITHOUT # A...
grembo/buildbot
master/setup.py
Python
gpl-2.0
20,409
[ "Brian" ]
229800312cc1257ec48933fc16f5a072c923304158cdabb86df2110f73178910
from __future__ import print_function import random import time import threading import thread from hashlib import md5 from DIRAC.Core.Utilities.ReturnValues import S_ERROR, S_OK from DIRAC.Core.Utilities.DIRACSingleton import DIRACSingleton class LockRing( object ): __metaclass__ = DIRACSingleton def __init__(...
fstagni/DIRAC
Core/Utilities/LockRing.py
Python
gpl-3.0
2,987
[ "DIRAC" ]
72eb085d053732ff87377ed750c87b6ec2da8eef0e020f043031146dce1d7219
""" Base classes used by studio tests. """ from bok_choy.page_object import XSS_INJECTION from common.test.acceptance.fixtures.course import CourseFixture from common.test.acceptance.fixtures.library import LibraryFixture from common.test.acceptance.pages.common.auto_auth import AutoAuthPage from common.test.accepta...
stvstnfrd/edx-platform
common/test/acceptance/tests/studio/base_studio_test.py
Python
agpl-3.0
6,561
[ "VisIt" ]
f03dd54a245aa485f5a0f3ecf61262402fc295bb374f4dea864e7e1e1be28a33
##------------------------------------------------------------------------- ## Author: Owen Arnold @ ISIS/Tessella ## Date: 24/03/2011 ## Purpose: Show signal cell data as surface plot. Sets color range between 0 and 3 for signal value. ## ##------------------------------------------------------------------------- try...
dymkowsk/mantid
qt/paraview_ext/PVPlugins/Macros/ShowSignal.py
Python
gpl-3.0
1,010
[ "ParaView" ]
238dac2707de088bfc73c9650cda5ea61644a6f5855b1e60a3c80d06d7950a0c
# this file does statistic analysis for the results # from collections import Counter from Bio.Blast import NCBIXML from Bio import SeqIO import os from combine_files import * #============analyse the output sam file : notchok1_virus.final.sort.sam========== #============================================================...
shl198/Pipeline
DetectVirus/reads_stat.py
Python
mit
12,645
[ "BLAST" ]
1cc938183561e416a6a9161f7bf17a24075ff071d79c2061edfc1f5f478046ef
# !/usr/bin/env python # -*- mode: python; coding: utf-8; -*- # --------------------------------------------------------------------------- # # Copyright (C) 1998-2003 Markus Franz Xaver Johannes Oberhumer # Copyright (C) 2003 Mt. Hood Playing Card Co. # Copyright (C) 2005-2009 Skomoroh # # This program is free softwar...
shlomif/PySolFC
pysollib/game/__init__.py
Python
gpl-3.0
123,237
[ "CASINO" ]
79fb2dd4f9b4d568735c71954cb07968fdacafbc8e5b6ac64bd262aa03ec7550
"""Factor Analysis. A latent linear variable model. FactorAnalysis is similar to probabilistic PCA implemented by PCA.score While PCA assumes Gaussian noise with the same variance for each feature, the FactorAnalysis model assumes different variances for each of them. This implementation is based on David Barber's B...
soulmachine/scikit-learn
sklearn/decomposition/factor_analysis.py
Python
bsd-3-clause
12,046
[ "Gaussian" ]
653d5c96c05806fe581c433639474468c576cc2b8f58e142f9bb60ecbc34c22c
""" pyparticleprobe.io.read_p3_2dimage_probe ========================= A grouping of scripts designed to read in various file formats containing data from 2-D precipitation and cloud imaging probes (PIP and CIP) aboard the NOAA WP-3D aircraft. Created by Nick Guy. """ # HISTORY:: # 8 Jan 2014 - Nick Guy. NRC,...
nguy/pyparticleprobe
pyparticleprobe/io/read_p3_2dimage_probe.py
Python
lgpl-2.1
23,133
[ "NetCDF" ]
b1048f549b173286e037af05cf74ed1eaac7c1ff932f9d0f806a3c843ced8044
# -*- coding: utf-8 -*- from south.utils import datetime_utils as datetime from south.db import db from south.v2 import SchemaMigration from django.db import models class Migration(SchemaMigration): def forwards(self, orm): # Adding field 'Subscription.is_active' db.add_column(u'visits_subscripti...
clincher/phuketstash
visits/migrations/0005_auto__add_field_subscription_is_active.py
Python
bsd-3-clause
9,061
[ "VisIt" ]
17a35705d28dae5085424c7c2f55ac5fca220ccc707d8609bd3baba6901524ec
""" Alpha diversity measures (:mod:`skbio.diversity.alpha`) ======================================================= .. currentmodule:: skbio.diversity.alpha This package provides implementations of various alpha diversity measures, including measures of richness, dominance, and evenness. Some functions generate confi...
jensreeder/scikit-bio
skbio/diversity/alpha/__init__.py
Python
bsd-3-clause
5,395
[ "scikit-bio" ]
dbe62e49f8533cb5fc80ed0cec2610431480ae661460a1c73153abbe1f6efe00
# This test calculates derivatives of lcao overlap matrices such as # # a ~a # P = < p | Phi > # i mu i mu # # and compares to finite difference results. from ase.data.molecules import molecule from ase.units import Bohr from gpaw import GPAW from gpaw.atom.basis import BasisMaker o...
qsnake/gpaw
oldtest/tci_derivative.py
Python
gpl-3.0
2,468
[ "ASE", "GPAW" ]
1837f0c05cdac672ebf4b9c8f9d8523f73b0fd903ba9501aa2b82b1f502f77bd
# Orca # # Copyright (C) 2010 Joanmarie Diggs # Copyright (C) 2011-2012 Igalia, S.L. # # Author: Joanmarie Diggs <jdiggs@igalia.com> # # This library 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; eith...
h4ck3rm1k3/orca-sonar
src/orca/scripts/toolkits/WebKitGtk/speech_generator.py
Python
lgpl-2.1
7,888
[ "ORCA" ]
daa19852ed2cc93ed54448dcc001651eeb1ae2179a78b9a96955aa19565d89d5
import unicodedata import numpy as np from .. import coding from ..core.variable import Variable # Special characters that are permitted in netCDF names except in the # 0th position of the string _specialchars = '_.@+- !"#$%&\\()*,:;<=>?[]^`{|}~' # The following are reserved names in CDL and may not be used as name...
xray/xray
xarray/backends/netcdf3.py
Python
apache-2.0
4,174
[ "NetCDF" ]
5b702aebd7eed41a09ea653d1537727c9665a90971f7fb2d55c12188ba9800af
# coding: utf-8 # Copyright (c) Pymatgen Development Team. # Distributed under the terms of the MIT License. """ Created on Jan 22, 2013 @author: Bharat Medasani """ import unittest import os from pymatgen.analysis.bond_valence import BVAnalyzer from pymatgen.command_line.gulp_caller import GulpIO, GulpCaller, \ ...
mbkumar/pymatgen
pymatgen/command_line/tests/test_gulp_caller.py
Python
mit
12,876
[ "GULP", "VASP", "pymatgen" ]
da0ffb0645d084d9e857dc9a2affe01f42e73f33551107406db425e718a14f80
# -*- coding: utf-8 -*- """Factories for the OSF models, including an abstract ModularOdmFactory. Example usage: :: >>> from tests.factories import UserFactory >>> user1 = UserFactory() >>> user1.username fred0@example.com >>> user2 = UserFactory() fred1@example.com Factory boy docs: http://f...
caneruguz/osf.io
tests/factories.py
Python
apache-2.0
29,464
[ "Brian" ]
0ba5b610cd2a7a8c7584fd8227fc51f90e9d1c96e08f9a757947d790a7ce04df
from netCDF4 import * from numpy import ndarray from sys import getsizeof class NetcdfCopier(object): """create a copy of the netcdf, can exclude certain variables and/or dimensions""" # vbl : variables black list # dbl : dimensions black list # f : format def copy(self,src,dst,dbl=[],vbl=[],f="NETCDF4")...
RDCEP/hybrid-dile-server
lib/utils/netcdfcopier.py
Python
apache-2.0
1,230
[ "NetCDF" ]
01cbea2812de8ceb02625ba6026bf191b1b377aff8cb9a2d2057f12e30730258
#!/usr/bin/python # -*- coding: utf-8 -*- # # --- BEGIN_HEADER --- # # oidping - Check OpenID server availability # Copyright (C) 2003-2015 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 General Public L...
heromod/migrid
mig/cgi-bin/oidping.py
Python
gpl-2.0
1,170
[ "Brian" ]
f2dbeedaa72dcfc3c07e1aa2b4dcce693a4b9d45f08d7ae762af945653cd1cdd
#!/usr/bin/python #Audio Tools, a module and set of tools for manipulating audio data #Copyright (C) 2007-2012 Brian Langenberger #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 2...
R-a-dio/python-audio-tools
test/test.py
Python
gpl-2.0
17,878
[ "Brian" ]
a0e008efbb8859d044588f33f56b477cd9155e2d9a6c84ece7b01ff50d461fa9
import cv2 import numpy as np #from skimage.measure import compare_ssim ''' MOG2 virtual int getHistory() const { return history; } virtual void setHistory(int _nframes) { history = _nframes; } virtual int getNMixtures() const { return nmixtures; } virtual void setNMixtures(int nmix) { nmixtures ...
barney-NG/pyCAMTracker
src/tracker/Background.py
Python
mit
10,695
[ "Gaussian" ]
b32256dc7c09768ebdc95e9a773d5d6f9c706c4bf98976ebd19d42e100d6c28a
""" ## Automatically adapted for numpy.oldnumeric Jun 27, 2008 by -c Replaced numpy.oldnumeric with numpy methods - Jan 2015, PGedeck """ #pylint: disable=E1101,C0111,R0904 import rdkit.Numerics.rdAlignment as rdAlg from rdkit import Geometry import unittest import numpy as np import math import copy def lstFeq(l1,...
bp-kelley/rdkit
Code/Numerics/Alignment/Wrap/testAlignment.py
Python
bsd-3-clause
5,911
[ "RDKit" ]
a7ec4c744156ec5ca70483f61c098713fe09bdf1d871bf7cfa5e885cbbb15981
# -*- coding: utf-8 -*- """SQLite parser plugin for Mozilla Firefox history database files.""" from dfdatetime import posix_time as dfdatetime_posix_time from plaso.containers import events from plaso.containers import time_events from plaso.lib import definitions from plaso.parsers import sqlite from plaso.parsers.s...
joachimmetz/plaso
plaso/parsers/sqlite_plugins/firefox_history.py
Python
apache-2.0
19,252
[ "VisIt" ]
0e7619e7e4f6f4ca452be38fcb36f8194633c4893b3a3921e4e282bf0494d64c
######################################################################## # $Id$ ######################################################################## """ The BQS TimeLeft utility interrogates the BQS batch system for the current CPU consumed and CPU limit. """ from DIRAC import gLogger, gConfig, S_OK, S_ERROR ...
avedaee/DIRAC
Core/Utilities/TimeLeft/BQSTimeLeft.py
Python
gpl-3.0
3,025
[ "DIRAC" ]
7a7d3954c0a81d575bdc7beab36e6bb56dc4d6d996cbd52119004da83aed5cdd
# coding: utf-8 # Copyright (c) Pymatgen Development Team. # Distributed under the terms of the MIT License. from __future__ import division, unicode_literals """ This module provides classes that operate on points or vectors in 3D space. """ __author__ = "Shyue Ping Ong" __copyright__ = "Copyright 2011, The Materi...
migueldiascosta/pymatgen
pymatgen/core/operations.py
Python
mit
14,998
[ "pymatgen" ]
d4fae7c6cb5796496f41c1cb42c208e041843802b175b45daa359835918d716a
from __future__ import absolute_import import re from collections import namedtuple, defaultdict from copy import deepcopy from datetime import datetime import six from django.utils.functional import cached_property from parsimonious.expressions import Optional from parsimonious.exceptions import IncompleteParseError...
mvaled/sentry
src/sentry/api/event_search.py
Python
bsd-3-clause
32,277
[ "VisIt" ]
ec618d8443d799d6d387145cb36989e0cf20359898205afc82dcb0fbfd3fc558
# Copyright (c) 2018, Henrique Miranda # All rights reserved. # # This file is part of the yambopy project # from yambopy import * from netCDF4 import Dataset from math import sqrt import numpy as np from cmath import exp from yambopy.units import ha2ev, ev2cm1, I class YamboElectronPhononDB(): """ Python clas...
henriquemiranda/yambo-py
yambopy/dbs/elphondb.py
Python
bsd-3-clause
8,789
[ "Yambo" ]
f32bd5c08c918a542354a780f017c942a382162303070d7f2acdfb1bf27394fe
# # Copyright (C) 2007, Mark Lee # #http://rl-glue-ext.googlecode.com/ # # 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...
mguzdial3/MineCode
python-codec/src/rlglue/agent/AgentLoader.py
Python
apache-2.0
1,942
[ "Brian" ]
d931cc42493ae6af05ac4d8e4eab1cdbaa6318c64a8bd90b175f4313c65372f7
#!/usr/bin/python # -*- coding: utf-8 -*- # # --- BEGIN_HEADER --- # # resedit - Front end to resource editor # 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 General Public Licen...
heromod/migrid
mig/cgi-bin/resedit.py
Python
gpl-2.0
1,075
[ "Brian" ]
60f61735b52293a86c8632a4f5f6baddec1af026180f10d5ba5d02e6041c5104
#!/usr/local/bin/python # -*- coding: utf8 """ this is a Library for SOM. CopyLight Masato MASUDA. 2017.23.AUG. """ import SOM.Map as Map import SOM.Coefficients as coef import SOM.logger as logger import SOM.SOM_config as SOM_config from SOM.Topology import hexagonal_tbl import numpy as np from numpy.random import ...
kinect110/RPSOM
src/SOM/Model.py
Python
mit
16,178
[ "Gaussian" ]
5702a7d1a78df01a16c0364b6313cb631b65b782d82b671f45955438e1e50e63
from galaxy.util import xml_text DEFAULT_REQUIREMENT_TYPE = "package" DEFAULT_REQUIREMENT_VERSION = None class ToolRequirement( object ): """ Represents an external requirement that must be available for the tool to run (for example, a program, package, or library). Requirements can optionally asser...
jmchilton/lwr
galaxy/tools/deps/requirements.py
Python
apache-2.0
3,157
[ "BWA", "Galaxy" ]
ada523eaaeedc2026d629d9cc44a9335d42982251c630de7cb564c447d15184c
#!/usr/bin/python3 #Author: Brian Raaen #Original code: https://www.brianraaen.com/2016/11/04/superputty-to-pac-manager/ # #This script can convert a SuperPutty Sessions.xml file to an Asbru-cm yaml file. The #resulting yaml file can then be imported into Asbru-cm. #This script does require tweaking for your personal s...
asbru-cm/asbru-cm
utils/asbru_from_superputty.py
Python
gpl-3.0
8,343
[ "Brian" ]
452087d2c4c04af9bc4d67a9d97c5dd216913d155e00b81b54417060355ac020
# -*- coding: utf-8 -*- # <nbformat>2</nbformat> # <codecell> # Demo python notebook for sklearn elm and random_hidden_layer modules # # Author: David C. Lambert [dcl -at- panix -dot- com] # Copyright(c) 2013 # License: Simple BSD # <codecell> from time import time from sklearn.cluster import k_means from dl_elm i...
alexsavio/elm-test
elm_notebook.py
Python
bsd-3-clause
6,787
[ "Gaussian" ]
e96b11a719ac0af15e099deee73d924434d52640b7387d705d64e8ff50f21b23
import mdtraj as md from simtk.openmm import app import simtk.openmm as mm from simtk import unit as u from fah_parameters import * deviceid = 2 ff_name = "amber99sbildn" water_name = 'tip3p' which_forcefield = "%s.xml" % ff_name which_water = '%s.xml' % water_name pdb_filename = "./OLDRUN0/system.pdb" out_pdb_fil...
kyleabeauchamp/fah-projects
code/equilibrate_npt.py
Python
gpl-2.0
2,006
[ "MDTraj", "OpenMM" ]
4fbe4dd7d716b8090352f091d30a4aaf46f9df0a404aa389bbd233d4445afed9
# -*- Mode: python; tab-width: 4; indent-tabs-mode:nil; coding: utf-8 -*- # vim: tabstop=4 expandtab shiftwidth=4 softtabstop=4 """ This example shows how to use pytim classes online during a simulation performed with openmm (http://mdtraj.org/) (see also the mdtraj interoperability) """ # openmm imports f...
balazsfabian/pytim
pytim/examples/example_openmm.py
Python
gpl-3.0
1,160
[ "MDTraj", "OpenMM" ]
d26e92f628c78d66a3290775bfbc637cd15a83463ecb85e119bade83d2d08854
import unittest import fun_bd class TestStringMethods(unittest.TestCase): def test_devuelve_clasificacion(self): clasi=fun_bd.selectClasificacion() self.assertEquals(clasi, fun_bd.selectClasificacion()) def test_devuelve_marcador(self): marc=fun_bd.selectMarcador() self.assertEquals(marc, fun_bd.selectMar...
manuelalonsobraojos/proyectoIV
bot_LaLiga/test.py
Python
gpl-3.0
616
[ "VisIt" ]
6141b218e6066a943723e8fc9b7990593e0ec196df161ac30179b1e01c23f235
# Copyright 2009 by Osvaldo Zagordi. All rights reserved. # Revisions copyright 2010 by Peter Cock. # This code is part of the Biopython distribution and governed by its # license. Please see the LICENSE file that should have been included # as part of this package. """Command line wrapper for the short read aligner ...
bryback/quickseq
genescript/Bio/Sequencing/Applications/_Novoalign.py
Python
mit
8,639
[ "Biopython" ]
c79d2cc707a593da49767e6d6fff02a9d05c62a8506589ff044338b85f3a47e5
""" EMBL format (:mod:`skbio.io.format.embl`) ========================================= .. currentmodule:: skbio.io.format.embl EMBL format stores sequence and its annotation together. The start of the annotation section is marked by a line beginning with the word "ID". The start of sequence section is marked by a li...
gregcaporaso/scikit-bio
skbio/io/format/embl.py
Python
bsd-3-clause
53,962
[ "scikit-bio" ]
ec9f5ec4bc56603f6e3c49800c86aa58cd8f3217c14d9ee3284c4d64206146f1
# coding: utf-8 from __future__ import unicode_literals from textwrap import dedent from kinko.i18n import Extractor, Translator from kinko.nodes import Tuple, Symbol, String, List from kinko.compat import PY3 from kinko.parser import parser from kinko.tokenizer import tokenize from .base import TestCase, NODE_EQ_PA...
vmagamedov/kinko
tests/test_i18n.py
Python
bsd-3-clause
1,747
[ "VisIt" ]
2c44107cc145b39721ad1d4bcbb72b879f1acf1fa070cbb3893a619cd2f1ad72
import json import logging import requests from urllib import urlencode from django.conf import settings from django.contrib.auth.views import logout as auth_logout from django.contrib import messages from django.contrib.auth.decorators import login_required from django.contrib.auth.models import User from django.http...
mozilla/mozillians
mozillians/phonebook/views.py
Python
bsd-3-clause
31,909
[ "VisIt" ]
b324afb710dec866cb038ff865b87cdfa6dc7a127203a9b57b89415fb3314f26
import py, re, os, signal, time, commands from subprocess import Popen, PIPE mod_re = (r"\bmodule\s+(", r")\s*\(\s*") func_re = (r"\bfunction\s+(", r")\s*\(") def extract_definitions(fpath, name_re=r"\w+", def_re=""): regex = name_re.join(def_re) matcher = re.compile(regex) return (m.group(1) for m in mat...
1up3d/Stallman
src/MCAD/openscad_utils.py
Python
gpl-3.0
1,933
[ "VisIt" ]
174f02033620f96196f05363845c1b71a971f6fc36b44484b6c3c76c0019bc2f
############################################################################### ## ## Copyright (C) 2014-2015, New York University. ## Copyright (C) 2011-2014, NYU-Poly. ## Copyright (C) 2006-2011, University of Utah. ## All rights reserved. ## Contact: contact@vistrails.org ## ## This file is part of VisTrails. ## ## ...
hjanime/VisTrails
vistrails/packages/vtk/vtk_wrapper/specs.py
Python
bsd-3-clause
26,973
[ "VTK" ]
9de40f7126379a77b03e5bcd8376cf9702d42ef7b085b6e430a91a6797431fbf
from django.conf import settings import urllib, subprocess, os, sys, datetime, mwclient ''' Handles linking PDB structure images to ProteinBox templates. ''' description_skeleton = '''== {{{{int:filedesc}} == {{{{Information | Description={{{{en | 1=Structure of protein {symbol}. Based on [[w:PyMol | PyMol]] rende...
SuLab/genewiki
genewiki/bio/images.py
Python
mit
7,651
[ "PyMOL" ]
6087a3593423be3baef6d05618244b2f3aeeff42ad51e68156b8ea817e161bc8
# This code is part of the Biopython distribution and governed by its # license. Please see the LICENSE file that should have been included # as part of this package. # """Tests the basic functionality of the GEO parsers. """ from __future__ import print_function import os import sys import Bio.Geo testfiles = ['...
updownlife/multipleK
dependencies/biopython-1.65/Tests/test_geo.py
Python
gpl-2.0
1,239
[ "Biopython" ]
635f9e48c74a0d4095ef2ab17712cc212409e765d2c99417611d61d8bbfc9a34
# # 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 in writing, software # distributed under ...
zzhao0/presto
presto-docs/src/main/sphinx/conf.py
Python
apache-2.0
5,695
[ "Amber" ]
dd0ef9f1d2fa45e7141998878fbb89da0d9576d18e4f31fe68206b57531177a7
from __future__ import (absolute_import, division, print_function) import re from six import string_types parNamePattern = re.compile(r'([a-zA-Z][\w.]+)') class FunctionParameters(object): """ A helper class that simplifies access to parameters of nested composite fitting functions. """ def __init__(...
ScreamingUdder/mantid
scripts/Inelastic/CrystalField/function.py
Python
gpl-3.0
26,175
[ "Gaussian" ]
59038c91957f71233609e6747c4a318b63c656a86c6d4a9ca73342bd8406625e
#!/usr/bin/env python # Copyright 2014-2018 The PySCF Developers. 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 # # U...
gkc1000/pyscf
pyscf/gto/ecp.py
Python
apache-2.0
5,175
[ "PySCF" ]
2ceb3de52c64c535ec43c7c37993dba10a5b9dd0cd105d61bff849ea4c375a92
# Copyright 2008 by Bartek Wilczynski. # Adapted from Bio.MEME.Parser by Jason A. Hackney. All rights reserved. # This code is part of the Biopython distribution and governed by its # license. Please see the LICENSE file that should have been included # as part of this package. from Bio.Alphabet import IUPAC from Bi...
BlogomaticProject/Blogomatic
opt/blog-o-matic/usr/lib/python/Bio/Motif/Parsers/MAST.py
Python
gpl-2.0
4,534
[ "Biopython" ]
bd281be86b480dc59635564a11bda0e399b5c958510f9b2a9289a328b8069446
""" cclib (http://cclib.sf.net) is (c) 2006, the cclib development team and licensed under the LGPL (http://www.gnu.org/copyleft/lgpl.html). """ __revision__ = "$Revision: 620 $" import sys if 'qt' in sys.modules.keys(): from qtprogress import QtProgress if 'PyQt4' in sys.modules.keys(): from qt4progress im...
connie/RMG-Java
source/cclib/progress/__init__.py
Python
mit
376
[ "cclib" ]
49ae66bd37e50f67a00423fadcb7d2e3286003c79b749c416eed5791898c2813
#!/usr/bin/env python """ wxBlender ========= wxPython in Blender Addon wxPython toolkit widgets running in Blender. Menus, Frames, Dialogs, Custom Buttons, Thumbnails, etc... ![wxBlender](https://raw.github.com/Metallicow/wxBlender/master/wxBlender_Screenshot.png) Requirements ------------ * Blender 2.65+(built w...
Metallicow/wxBlender
wx_blender/wxblender.py
Python
gpl-2.0
24,689
[ "VisIt" ]
7d703eb5e5a6e842a01381f4dad0af3f16a55def58075be93d9ea7f3dbc7d1bc