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#!/usr/bin/env python # -*- coding: utf-8 -*- # # Copyright (c) 2013 Spotify AB # # 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 requi...
LongbinChen/annoy
setup.py
Python
apache-2.0
2,123
[ "VisIt" ]
23822ac915d3c44bc978d607e344a37dcd57715de679cd9ecf9e80029778f14c
import types import os import re import logging import urllib import hmac import hashlib from urlparse import urlparse from email import header from datetime import timedelta, datetime from hashlib import sha256 import uuid import iso8601 import pymongo from pylons import c, g, request from ming import schema as S fr...
Bitergia/allura
Allura/allura/model/auth.py
Python
apache-2.0
22,147
[ "VisIt" ]
59c1de108f368fa9a33b5c191c35786898a625aeb04922d4392ac56c1e2de10f
# Licensed under an MIT open source license - see LICENSE import numpy as np import matplotlib.pyplot as p import scipy.ndimage as nd from scipy.stats import lognorm from scipy.ndimage import distance_transform_edt from skimage.morphology import remove_small_objects, medial_axis from scipy.stats import scoreatpercenti...
e-koch/FilFinder
fil_finder/filfind_class.py
Python
mit
72,225
[ "Gaussian" ]
deefc7dd92c0940e6487f794fb6cfb5b3fd50b3b4e181b6fada9d40fa5020379
import saliweb.frontend import os import math import re class ValueWithError: def __init__(self, value, err): self.value = value self.err = err if err == 'nan' else float(err) def has_error(self): return self.err != 'nan' and self.err < self.value/10. class Results: def __init__...
salilab/saxsmerge
frontend/saxsmerge/results_page.py
Python
lgpl-2.1
3,000
[ "Gaussian" ]
9631a5b5e31d6509a030e9b7865cc39fd54f98fd0d0e7894b622cc0d1f9a6b3b
###################################################################### # Copyright (C) 2015 Jaakko Luttinen # # This file is licensed under Version 3.0 of the GNU General Public # License. See LICENSE for a text of the license. ###################################################################### ####################...
dungvtdev/upsbayescpm
bayespy/inference/vmp/nodes/logistic.py
Python
mit
6,911
[ "Gaussian" ]
abc622d8adcb26f99d664333a7793b957c9712f977c5b2798c132fe08d39c80c
from math import *; from utils import *; import random; import soldiers; import towers; #class ProbGene(FloatGene): # """ # Gene which represents the probabilities used in our organism # """ # # genes get randomly generated within this range # randMin = 0.0 # randMax = 1.0 # # probability of mutat...
ggianna/Foragers
unitStrategy.py
Python
apache-2.0
8,953
[ "VisIt" ]
2c66116faa0e1f5afe9a4c37d0104899eeb780cc8583d16aeaa61bb51f2fe40a
# coding=utf8 # # Copyright 2013 Dreamlab Onet.pl # # 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; # version 3.0. # This library is distributed in the hope that it will be useful, # bu...
tikan/rmock
tests/unit_tests/test_tools.py
Python
lgpl-3.0
3,103
[ "VisIt" ]
c32a6bbd934ae38aedeebd5f1baf883e3c12aea65d3399c6600546bd47ae5165
import numpy as np from copy import copy from bokeh.core.properties import field from bokeh.io import curdoc from bokeh.layouts import layout,column,row from bokeh.models import ( ColumnDataSource, HoverTool, SingleIntervalTicker, Slider, Button, Label, CategoricalColorMapper, ) from bokeh.models.widgets import...
sandipde/bokehplot
plot-server/cosmo.py
Python
mit
20,325
[ "Jmol" ]
0ad376d13bb84c71f13434653749e9e388e3c4c8d625cb625e9b5ae54ff13679
from __future__ import absolute_import import cython cython.declare(PyrexTypes=object, Naming=object, ExprNodes=object, Nodes=object, Options=object, UtilNodes=object, LetNode=object, LetRefNode=object, TreeFragment=object, EncodedString=object, error=object, warning=object...
Architektor/PySnip
venv/lib/python2.7/site-packages/Cython/Compiler/ParseTreeTransforms.py
Python
gpl-3.0
122,032
[ "VisIt" ]
1a1784d5f821b75178b24c964d293b89dcbab764ce7adfc81ddd69b6fdcc71a4
""" Computational Neurodynamics Exercise 1 Simulates Izhikevich's neuron model using the Runge-Kutta method. Parameters for regular spiking, fast spiking and bursting neurons extracted from: http://www.izhikevich.org/publications/spikes.htm (C) Murray Shanahan et al, 2015 """ import sys import matplotlib.pyplot as ...
lawrencejones/neuro
Exercise_1/IzNeuronDemo.py
Python
gpl-3.0
1,176
[ "NEURON" ]
1d4434f86aea3bb5204e826d087470b96bc7fb2d3fc88d5bbaad76394497d20f
""" Protocol implementations for PES5 """ from twisted.internet import reactor, defer from twisted.application import service from twisted.web import client from Crypto.Cipher import Blowfish from datetime import datetime, timedelta from hashlib import md5 import binascii import struct import time import re import zl...
IkeC/evo-league
Sixserver/lib/fiveserver/protocol/pes5.py
Python
mit
64,934
[ "VisIt" ]
1660d07fdfe19a01d3baab2fd27da13448c8717fba0ab4e11e7ffcd67d2134a1
# -*- coding: utf-8 -*- # emacs: -*- mode: python; py-indent-offset: 4; indent-tabs-mode: nil -*- # vi: set ft=python sts=4 ts=4 sw=4 et: """Provides interfaces to various commands provided by FreeSurfer Change directory to provide relative paths for doctests >>> import os >>> filepath = os.path.dirname( os.p...
carolFrohlich/nipype
nipype/interfaces/freesurfer/preprocess.py
Python
bsd-3-clause
92,925
[ "Gaussian" ]
f704f9e88ae0e70119e7f293244859509a7803bcd83d6a309a026133402988c8
############################################################## # Trilogy - Color / grayscale image maker (from FITS input) # Dan Coe # http://www.stsci.edu/~dcoe/trilogy/ ############################################################## # Trilogy produces nice color / grayscale images based on your input FITS files # Jus...
willettk/decals
python/trilogy.py
Python
mit
43,553
[ "Galaxy" ]
9f4ca06626b9fffeddf2521199a7adc47a24e841cae4d3972aa3adbb5745c1dc
# ---------------------------------------------------------------------------- # 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. # --------------------------------------------...
Achuth17/scikit-bio
skbio/stats/ordination/tests/test_ordination.py
Python
bsd-3-clause
35,785
[ "scikit-bio" ]
f38ffa3742fb20bfa26628436a542f21b01c4330f8028807d3b0b99d0d965fd8
# Copyright 2021, The TensorFlow Authors. # # 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 # # https://www.apache.org/licenses/LICENSE-2.0 # # Unless required by applicable law or agreed t...
google/differential-privacy
python/dp_accounting/dp_event.py
Python
apache-2.0
7,925
[ "Gaussian" ]
a986febc58d73f8bc0e88d0f39e89fde04aa6171bd294c6f0f9eedb4557d2d96
# Copyright (c) 2012 Google Inc. All rights reserved. # Use of this source code is governed by a BSD-style license that can be # found in the LICENSE file. from compiler.ast import Const from compiler.ast import Dict from compiler.ast import Discard from compiler.ast import List from compiler.ast import Module from co...
cchamberlain/gyp
pylib/gyp/input.py
Python
bsd-3-clause
115,520
[ "VisIt" ]
3c41881d51df972d331a5100576d8f0a85a8a5817f89f1931f8dc4f6fe554ba9
import imgaug as ia from imgaug import augmenters as iaa import numpy as np import glob import matplotlib.image as img import matplotlib.pyplot as plt import cv2 images= img.imread("/home/ahmed/Pictures/cogedis/cogedis_words_3/fe27c8de-15d5-4361-a079-558a4bee2388.png") plt.imshow(images) # random example images #imag...
ahmedmazari-dhatim/CRNN-for-sequence-recognition-
data_augm.py
Python
mit
2,887
[ "Gaussian" ]
06a67d283a3ab573a391e895e7a3c722ec7e8e797aada38434441ddc4495bf1d
# S.D. Peckham # May 2010 import os import sys import time import numpy as np import file_utils # import rti_files # (not used) import netCDF4 as nc #--------------------------------------------------------------------- # This class is for I/O of time-indexed 1D profiles to netCDF files. #-----------------------...
peckhams/topoflow
topoflow/utils/ncps_files.py
Python
mit
24,881
[ "NetCDF" ]
357601360060b483d82f1da049499a2f67f8e753400c29e50a42b1f734a143ba
""" Forest of trees-based ensemble methods. Those methods include random forests and extremely randomized trees. The module structure is the following: - The ``BaseForest`` base class implements a common ``fit`` method for all the estimators in the module. The ``fit`` method of the base ``Forest`` class calls th...
anntzer/scikit-learn
sklearn/ensemble/_forest.py
Python
bsd-3-clause
100,288
[ "Brian" ]
ca0ccf87d070d99c44c60b845fb21033ad65c34ca57551e7cef6baa580462e7f
from DIRAC.Core.Base import Script Script.parseCommandLine() from ILCDIRAC.Interfaces.API.DiracILC import DiracILC from ILCDIRAC.Interfaces.API.NewInterface.UserJob import * from ILCDIRAC.Interfaces.API.NewInterface.Applications import * dirac = DiracILC( True , "CLICdet_repo.cfg" ) job = UserJob( ) job.setName( "ex...
iLCSoft/CLICPerformance
Flavour_tagging/Job_example.py
Python
gpl-3.0
2,088
[ "DIRAC" ]
edb173d0cd206d40745408e2453b0568709570a88048c64ce4d1549c24857c5b
#!/usr/bin/env ipython from pylab import * from numpy import * from scipy.io.netcdf import netcdf_file from datetime import datetime, time, timedelta #------------ shared libraries: import sys sys.path.append('../../../shared_lib') from shared_funcs import * #c_funcs import * #------------------------------ #from read_...
jimsrc/seatos
mcs/src/forbush/c_rebineo.py
Python
mit
3,336
[ "NetCDF" ]
c9ff767adfe313984bd036de8972260b0458bcb1f638bb8f7000b5171a9996b1
# -*- test-case-name: twisted.python.test.test_deprecate -*- # Copyright (c) Twisted Matrix Laboratories. # See LICENSE for details. """ Deprecation framework for Twisted. To mark a method, function, or class as being deprecated do this:: from twisted.python.versions import Version from twisted.python.deprec...
Architektor/PySnip
venv/lib/python2.7/site-packages/twisted/python/deprecate.py
Python
gpl-3.0
24,319
[ "Amber" ]
6edab2791328c9f601f59ed99a230ce2dc5634366e00a0a7b5ca6e8aff02e1c5
# # Gramps - a GTK+/GNOME based genealogy program # # Copyright (C) 2002-2007 Donald N. Allingham # Copyright (C) 2007-2008 Brian G. Matherly # Copyright (C) 2008 Jerome Rapinat # Copyright (C) 2008 Benny Malengier # # This program is free software; you can redistribute it and/or modify # it under the terms of the ...
arunkgupta/gramps
gramps/gen/filters/rules/person/_hasnote.py
Python
gpl-2.0
1,717
[ "Brian" ]
31ee1a28c5c56535cf61fc7486ead69552a204e25098d6ee6eb2bc462e5e48d0
# opts.py - module to parse command line options and output what parameters will be used for this run import os import os.path import json import sys import yaml from argparse import ArgumentParser # fs-drift module dependencies from common import OK, NOTOK, FsDriftException, FileAccessDistr, USEC_PER_SEC, BYTES_PER...
parallel-fs-utils/fs-drift
opts.py
Python
apache-2.0
28,701
[ "Gaussian" ]
61142d791eb7dc941c43a1df9c59df5bc02b3f4e741842bc82f1e4a4eceae7c1
# BEGIN_COPYRIGHT # # Copyright 2009-2015 CRS4. # # 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 ...
crs4/seal
seal/avo2sam_mr.py
Python
gpl-3.0
3,902
[ "BWA" ]
4c0d84177eeb62a6f86bf93793acb7056b4df0e8a4537bc75cda4a2770a3d001
import numpy as np ######## BIN_SPIKES ######## def bin_spikes(spike_times,dt,wdw_start,wdw_end): """ Function that puts spikes into bins Parameters ---------- spike_times: an array of arrays an array of neurons. within each neuron's array is an array containing all the spike times of tha...
wosen7/openblackbox
preprocessing_funcs.py
Python
gpl-3.0
5,617
[ "NEURON" ]
a4b8088acf4d2d28e610aa284f55d926b0891c0a692bfe506a1a92f79afb5115
from ase import * #from math import sqrt #from ASE.Calculators.PairPotential import PairPotential #from ASE.Filters.Subset import Subset #from ASE.Filters.FixBondLength import FixBondLength #from ASE.Dynamics.MDMin import MDMin #from ASE.Trajectories.NetCDFTrajectory import NetCDFTrajectory #from ASE.IO.NetCDF import...
conwayje/ase-python
tutorials/N2Ru-Association.py
Python
gpl-2.0
1,192
[ "ASE", "NetCDF" ]
e1abc8f557f2b46ce3b7d670efdead2a381d0e2bc1dc140d6805c2aab25ba275
import caching.base as caching import jingo import jinja2 from tower import ugettext_lazy as _ from olympia import amo from olympia.addons.models import Addon from olympia.api.views import addon_filter from olympia.bandwagon.models import Collection, MonthlyPick as MP from olympia.versions.compare import version_int ...
jpetto/olympia
src/olympia/discovery/modules.py
Python
bsd-3-clause
11,357
[ "VisIt" ]
c8e35c5f2eec99674f0c46af6c1ca26747b4ed0482a84b7dad7c0474f3270b8b
''' module for building and loading all the possible data and covariance combinations that can come up in the generalised inference ''' #general python modules import numpy as np from multiprocessing import cpu_count import pyfof #haltools functions from halotools.sim_manager import CachedHaloCatalog from halotools....
mjvakili/ccppabc
ccppabc/code/data.py
Python
mit
15,938
[ "Galaxy" ]
90853f0554043b48a9ef7e4bb20c51015598fbbcffeb74b348d1814ae17db8f4
# -*- coding: utf-8 -*- # Unit tests for cache framework # Uses whatever cache backend is set in the test settings file. from __future__ import unicode_literals import copy import os import re import shutil import tempfile import threading import time import unittest import warnings from django.conf import settings ...
marqueedev/django
tests/cache/tests.py
Python
bsd-3-clause
84,798
[ "Brian" ]
65432d0873d9cc7ce780266378df2f27c6324a34d45944028f862b6d388ea3fa
"""Example to solve 3D aqueous foam pipe flow using rheological Herschel-Bulkley power law for bulk and wall shear stress dependent slip velocity law for wall layer """ import numpy as np import foam_controlwrapper from simphony.core.cuba import CUBA from simphony.api import CUDS, Simulation from simphony.cuds.meta i...
simphony/simphony-openfoam
foam_controlwrapper/examples/aqueous_foam_slit_flow_steady_state_meso_coupling.py
Python
gpl-2.0
6,008
[ "Mayavi" ]
f20da9c33330ba3a91a731f27a983de5a93f03c05274196242f63c252fc23b9b
""" murder_if_convenient's first priority is to murder other robots, but only if they happen to be right in the way. Otherwise he'll head for the flag as best as possible, attempting to follow an obsticle if one is in the way. """ from roborally.api import * name = 'ConvenientMurderer' friendly_bots = ('ConvenientMur...
kenganong/robot-arena
robotarena/roborally/robots/murder_if_convenient.py
Python
apache-2.0
7,546
[ "BLAST" ]
3be929f8d782d00acd422e719e111cfd2dcde44f4cfb8250976c54f2326af607
# -*- coding: utf-8 -*- # imports here from aiida.parsers.exceptions import OutputParsingError # from aiida.orm.data.folder import FolderData from aiida.orm.data.parameter import ParameterData from aiida.orm.data.structure import StructureData from aiida.orm.data.array import ArrayData # from aiida.parsers.plugins.vas...
abelcarreras/aiida_extensions
plugins/parsers/vasp/instruction/data/custom_vasprun_parser.py
Python
mit
3,076
[ "VASP", "phonopy", "pymatgen" ]
42a2471ed60abe84eb549815ae2b69cd69babcf5659ffe9f5e396a46de5841a2
# analogStimTable.py --- # # Filename: analogStimTable.py # Description: # Author: Upi Bhalla # # 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, or # (at your option) a...
BhallaLab/moose-examples
snippets/analogStimTable.py
Python
gpl-2.0
3,666
[ "MOOSE" ]
eff86c85f78187127f4dbb0737bd1f1864a4cba86c2e748ad254aff3913f35ca
__author__ = 'tylin' __version__ = '2.0' # Interface for accessing the Microsoft COCO dataset. # Microsoft COCO is a large image dataset designed for object detection, # segmentation, and caption generation. pycocotools is a Python API that # assists in loading, parsing and visualizing the annotations in COCO. # Pleas...
wuzheng-sjtu/FastFPN
libs/datasets/pycocotools/coco.py
Python
apache-2.0
18,434
[ "VisIt" ]
da862c8f815180c7295bf00bb608287546b4f508890ebbd60f7ba3cec8a5a9f3
"""Create and put Requests to archive files. List of operations: #. Optionally replicate files to SourceSE #. ArchiveFiles: Create a tarball from input files, upload tarball to TarballSE #. ReplicateAndRegister Tarball to TargetSE #. Optionally: Add LFNs to an ArchiveSE #. Optionally: Check for Tarball Migration #. ...
andresailer/DIRAC
DataManagementSystem/scripts/dirac-dms-create-archive-request.py
Python
gpl-3.0
21,130
[ "DIRAC" ]
cfa8c49377b97cb97ca72ab9d4e835704097654433937f0f7ac9574e1a36fc1e
""" .. module:: :platform: Unix :synopsis: ??? .. moduleauthor: Jan Hajic <hajicj@gmail.com> """ import cPickle import numpy import safire.utils import theano import theano.tensor as TT from theano.tensor.shared_randomstreams import RandomStreams from safire.learning.models.autoencoder import Autoencoder c...
hajicj/safire
build/lib/safire/learning/models/denoising_autoencoder.py
Python
gpl-3.0
8,007
[ "NEURON" ]
a6cc61b5c44d9029268231d48e4d3155d74c1725c93b3a9029b0da738996f99e
from __future__ import absolute_import, division, print_function import os import pickle import shutil import warnings from collections import OrderedDict, defaultdict from enum import Enum from numbers import Number import numba as nb import numpy as np from scipy.io import wavfile from odin import fuel as F from o...
imito/odin
examples/nist_sre/helpers.py
Python
mit
40,884
[ "Gaussian" ]
aaebc73edca6803b741df434faedfbd39552ee97331a387617a8dce4d66c18f5
# AUTHORS: # Hakan Ozadam # Rachel Brown # # Moore Laboratory # UMASS Medical School / HHMI # RNA Therapeutics Institute # Albert Sherman Center, ASC4-1009 # 368 Plantation Street # Worcester, MA 01605 # USA # ##############################################...
hakanozadam/bal
bal/genomic_io/functions.py
Python
gpl-2.0
4,143
[ "pysam" ]
a85cafb6776048f2326e8c179bdbe4d58ea6542ac97f39b8cdbf75e0a7c361de
# -*- coding: utf-8 -*- """ End-to-end tests for Student's Profile Page. """ from contextlib import contextmanager from datetime import datetime from bok_choy.web_app_test import WebAppTest from nose.plugins.attrib import attr from ...pages.common.logout import LogoutPage from ...pages.lms.account_settings import Acc...
ampax/edx-platform
common/test/acceptance/tests/lms/test_learner_profile.py
Python
agpl-3.0
34,952
[ "VisIt" ]
321f3b106e51040c61af5a6de5992ac8517bf563e2b9ded8f5a8296a6623c9ef
# -*- coding: utf-8 -*- # Copyright(C) 2008-2011 Romain Bignon # # This file is part of weboob. # # weboob 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, either version 3 of the License, or # (at you...
Boussadia/weboob
modules/aum/contact.py
Python
agpl-3.0
11,686
[ "exciting" ]
c9978ea376e1778571625f06de11c833640257c0ee725ebe16e177940587c4d7
#!/usr/bin/env python # -*- coding: utf-8 -*- ''' MellPlayer Player Created on 2017-02-20 @author: Mellcap ''' import os import time import threading import datetime from mellplayer.utils.mpv import MPV from mellplayer.api import Netease from mellplayer.directory import BASE_DIRECTORY from mellplayer.event.ui_event...
Mellcap/MellPlayer
mellplayer/player.py
Python
mit
10,095
[ "VisIt" ]
4e62458c472c4e57b7adbd496dd685f92dc600cfc16bbe148a3f6abc517dc4a5
""" Generate coulomb matrices for molecules. See Montavon et al., _New Journal of Physics_ __15__ (2013) 095003. """ from __future__ import print_function from __future__ import division from __future__ import unicode_literals __author__ = "Steven Kearnes" __copyright__ = "Copyright 2014, Stanford University" __licen...
joegomes/deepchem
deepchem/feat/coulomb_matrices.py
Python
mit
7,736
[ "RDKit" ]
0234e42e3afd742ff5fdf689730cf925fdb0271ff21744e5c8fec17cf5f355ba
# $Id$ # # 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 ...
rvianello/rdkit
rdkit/Dbase/UnitTestDbUtils.py
Python
bsd-3-clause
7,275
[ "RDKit" ]
f9b70a3e44d745ca568b33a42e3b22fe34f7298fdc9d1a8ae9a63ae41adebba8
#!/usr/bin/env python # encoding: utf-8 """ CijUtil.py Bits to help with elastic constants manipulation. polyCij(Cij): Given an elastic constants matrix for a single crystal, calculate the Voight and Reuss bounds on the bulk and shear moduli for a random polycrystal. Copyright (c) 2010 A...
duyuan11/elastic-constants
CijUtil.py
Python
bsd-3-clause
13,338
[ "CRYSTAL" ]
2a8c527ea42285f81eab85df3664955fc446663877609e4d95c2c9ddd9d14ef6
""" This module will run some job descriptions defined with an older version of DIRAC """ # pylint: disable=protected-access, wrong-import-position, invalid-name, missing-docstring import unittest import os import sys import shutil import DIRAC DIRAC.initialize() # Initialize configuration from DIRAC import gLogger...
DIRACGrid/DIRAC
tests/Workflow/Regression/Test_RegressionUserJobs.py
Python
gpl-3.0
3,310
[ "DIRAC" ]
1b34139cd91ea1570e1fe0befb0e30d2b77d1a42e9528431459633a7fb488d7a
# Copyright 2016 Mark Benson, portions Copyright 2016 Brian Innes # # 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 app...
brianinnes/pycupi
python/vPiP/generators/concircle.py
Python
apache-2.0
3,534
[ "Brian" ]
ae57af446de46eee583fd4f93e37c43cc40a05620258b1cc1447caeaa2d7963f
# -*- coding: utf-8 -*- from acq4.Manager import getManager from acq4.util.metaarray import * from acq4.pyqtgraph.ImageView import * from acq4.pyqtgraph.GraphicsView import * from acq4.pyqtgraph.graphicsItems import * from acq4.pyqtgraph.graphicsWindows import * from acq4.pyqtgraph.PlotWidget import * from acq4.pyqtgra...
hiuwo/acq4
acq4/analysis/old/modules.py
Python
mit
103,125
[ "Gaussian" ]
09f85b7100552e7899ec6f6171cabcdc82d7305b016f7f742eaac0f1ec705aec
# Copyright (c) 2015, Ecole Polytechnique Federale de Lausanne, Blue Brain Project # All rights reserved. # # This file is part of NeuroM <https://github.com/BlueBrain/NeuroM> # # Redistribution and use in source and binary forms, with or without # modification, are permitted provided that the following conditions are ...
lidakanari/NeuroM
neurom/fst/__init__.py
Python
bsd-3-clause
7,218
[ "NEURON" ]
f3cdf216316443733653823c972eb05db09973e493d75db067eb3b6ce20072d3
""" Extremely simple utility class to send mails """ from __future__ import absolute_import from __future__ import division from __future__ import print_function import six import os import socket from smtplib import SMTP, SMTP_SSL from email.mime.application import MIMEApplication from email.mime.multipart impor...
yujikato/DIRAC
src/DIRAC/Core/Utilities/Mail.py
Python
gpl-3.0
3,906
[ "DIRAC" ]
e89919dbdcb8b799386633e05f65d7bcb9b8658ce66ba305afa5c770badb8034
import io import json import os from collections import OrderedDict from datetime import date, datetime, timedelta from django.contrib import messages from django.contrib.auth.mixins import PermissionRequiredMixin from django.core.mail import EmailMessage from django.db.models import Count from django.http import Fil...
epcoullery/epcstages
stages/views/__init__.py
Python
agpl-3.0
24,912
[ "ASE" ]
003df9241fe2691873102482c26d6128d472faf1147c1c6454915a00846e011d
# encoding: utf-8 ''' @author: Juncheng Chen @copyright: 1999-2015 Alibaba.com. All rights reserved. @license: Apache Software License 2.0 @contact: juncheng.cjc@outlook.com ''' import sys import os from argparse import ArgumentParser from argparse import RawDescriptionHelpFormatter from time import slee...
alibaba/tvb
tvb/cli.py
Python
apache-2.0
7,745
[ "VisIt" ]
b97551eaa60a99929a65953c9fdb6995fa5c9a341a541f056f1c6c6005f34ef5
"""The registration module contains classes for image registration. Image registration aims to align two images using a particular transformation. miapy currently supports multi-modal rigid registration, i.e. align two images of different modalities using a rigid transformation (rotation, translation, reflection, or t...
Studijacob/MIALab
wd/registration/registration.py
Python
apache-2.0
16,836
[ "Gaussian" ]
eac76ccb21902742257861e1e56bbdf6e2e12a6a20e6fd5113dffe17f136505f
#!/usr/bin/env python # -*- coding: utf-8 -*- # # Copyright © 2015 Matthew Stone <mstone5@mgh.harvard.edu> # Distributed under terms of the MIT license. """ """ import argparse import heapq from collections import deque import pysam from svcf.rpc import RPC from svcf.svcall import SVCallCluster from svcf.svfile impo...
talkowski-lab/Holmes
readpaircluster/svcf/svcluster.py
Python
mit
5,040
[ "pysam" ]
f454d8867f38c0702623a2176bcfcfa550984090306b22a88e2fc5396e2c38d6
""" It is used to create plots using Elasticsearch """ import datetime import os from DIRAC import gLogger, S_OK, S_ERROR, gConfig from DIRAC.Core.DISET.RequestHandler import RequestHandler from DIRAC.Core.Utilities import Time from DIRAC.Core.Utilities.Plotting import gDataCache from DIRAC.Core.Utilities.Plotting.F...
fstagni/DIRAC
MonitoringSystem/Service/MonitoringHandler.py
Python
gpl-3.0
12,881
[ "DIRAC" ]
e77ebbb0d6275f2a1fd1135a83f126397cd7a91675b7cee8cf3a5669e68decc2
# pylint: disable=arguments-differ """ Models for the shopping cart and assorted purchase types """ from __future__ import absolute_import import csv import json import logging import smtplib from collections import namedtuple from datetime import datetime, timedelta from decimal import Decimal import pytz import si...
ESOedX/edx-platform
lms/djangoapps/shoppingcart/models.py
Python
agpl-3.0
90,012
[ "VisIt" ]
e9e1239e24b2f5f32a1b5f303049a5b208d6d5b9fbecad9d28a68e6c52fd26ae
r""" This module is a VTK Web server application. The following command line illustrate how to use it:: $ vtkpython .../vtk_web_graph.py --vertices 1000 --edges 400 Any VTK Web executable script come with a set of standard arguments that can be overriden if need be:: --host localhost ...
johnkit/vtk-dev
Web/Applications/GraphLayout/server/vtk_web_graph.py
Python
bsd-3-clause
6,395
[ "VTK" ]
9dd662e6f98286a72f745f07d45d8d478ac9c828cdddc1d7bca08a66c8f95687
""" Linear Discriminant Analysis and Quadratic Discriminant Analysis """ # Authors: Clemens Brunner # Martin Billinger # Matthieu Perrot # Mathieu Blondel # License: BSD 3-Clause from __future__ import print_function import warnings import numpy as np from scipy import linalg from .extern...
pratapvardhan/scikit-learn
sklearn/discriminant_analysis.py
Python
bsd-3-clause
28,512
[ "Gaussian" ]
9d27ea24e1cca07a3eb7a8195c654002ea42ecdf80af44dbaef21a413ac56a83
#! /usr/bin/env python #import __main__ #__main__.pymol_argv = ['pymol','-qc'] ##__main__.pymol_argv = ['pymol',''] #import sys,time,os #import pymol # #pymol.finish_launching() #pymol.cmd.feedback("disable","all","actions") #pymol.cmd.feedback("disable","all","results") #sys.path.append("/home/scratch/software/Pymol-...
demharters/git_scripts
contacts_dna_4dnb.py
Python
apache-2.0
1,332
[ "MDAnalysis", "PyMOL" ]
5be5b2bff195986fcb622ffaeea206dd079df57cbfb78ecd0aca133ec2cc03f3
# # @BEGIN LICENSE # # Psi4: an open-source quantum chemistry software package # # Copyright (c) 2007-2018 The Psi4 Developers. # # The copyrights for code used from other parties are included in # the corresponding files. # # This file is part of Psi4. # # Psi4 is free software; you can redistribute it and/or modify #...
amjames/psi4
psi4/driver/qcdb/physconst.py
Python
lgpl-3.0
3,475
[ "Psi4" ]
b6640528754434bed724f214ce6a9f5c1acd7375c711c69840940814b39ab5ce
""" Utility module to make it easier to create new keys. """ from vtk.vtkCommonCore import vtkInformationDataObjectKey as DataaObjectKey from vtk.vtkCommonCore import vtkInformationDoubleKey as DoubleKey from vtk.vtkCommonCore import vtkInformationDoubleVectorKey as DoubleVectorKey from vtk.vtkCommonCore import vtkInfo...
msmolens/VTK
Wrapping/Python/vtk/util/keys.py
Python
bsd-3-clause
1,906
[ "VTK" ]
107323baf1f118937205fe4718e76d0ea6fb24de4421ee9e8d601cfa0e464abd
# copyright 2003-2013 LOGILAB S.A. (Paris, FRANCE), all rights reserved. # contact http://www.logilab.fr/ -- mailto:contact@logilab.fr # # This file is part of logilab-astng. # # logilab-astng is free software: you can redistribute it and/or modify it # under the terms of the GNU Lesser General Public License as publis...
tlksio/tlksio
env/lib/python3.4/site-packages/logilab/astng/inspector.py
Python
mit
9,469
[ "VisIt" ]
638fdb4fa32b09fc713b2333f16a07d1b6b53120ffca2602e1499e679f37dec3
#!/usr/bin/env python from __future__ import print_function import gzip import json import optparse import os import os.path import re import shutil import sys import urllib import zipfile from pysam import ctabix """ # Install dbNSFP databases # from DbNsfp site # Download dbNSFP database $ wget ftp://dbnsfp:...
nekrut/tools-iuc
data_managers/data_manager_snpsift_dbnsfp/data_manager/data_manager_snpsift_dbnsfp.py
Python
mit
7,844
[ "pysam" ]
caca813a11195adea0fea480b8f601cbed15aab7458245e4a7e021b13717cb04
#!/usr/bin/env python # # Appcelerator Titanium Module Packager # # import os, subprocess, sys, glob, string import zipfile from datetime import date cwd = os.path.abspath(os.path.dirname(sys._getframe(0).f_code.co_filename)) os.chdir(cwd) required_module_keys = ['name','version','moduleid','description','copyright','...
atsusy/TiPaperFold
build.py
Python
mit
6,525
[ "VisIt" ]
86e37ddf67c915b9aa90f1c49e01c1c3fe3888093da0bc61da977541004664eb
#!/usr/bin/env python """ This script retrieves the output of all the jobs of a given test. <jobName> is the path of the directory created by submitMyJob """ from __future__ import print_function from __future__ import absolute_import from __future__ import division from DIRAC.Core.Base.Script import parseComman...
yujikato/DIRAC
tests/Performance/DFCPerformance/retrieveResult.py
Python
gpl-3.0
1,217
[ "DIRAC" ]
9821786170d7d1c507f2c381abeafc78b555bc0480d8ce0a97aeaca434e82a96
#!/usr/bin/python import numpy as np import os import sys import math import matplotlib matplotlib.use('Pdf') import matplotlib.pyplot as plt from mpl_toolkits.axes_grid1 import make_axes_locatable from matplotlib.backends.backend_pdf import PdfPages import matplotlib.font_manager as fm import galsim import galsim.w...
plazas/wfirst-detectors-vnl
code/analytical_gaussian_size_error.py
Python
mit
4,711
[ "Gaussian" ]
9eaac915bf82433b51dcfd3a086ed8ea1b592ef7e26876f9c816a628c8a6a1e6
#!/usr/bin/env python """ Convert a mesh file from one SfePy-supported format to another. Examples:: $ ./script/convert_mesh.py meshes/3d/cylinder.mesh new.vtk $ ./script/convert_mesh.py meshes/3d/cylinder.mesh new.vtk -s2.5 $ ./script/convert_mesh.py meshes/3d/cylinder.mesh new.vtk -s0.5,2,1 $ ./script/conve...
lokik/sfepy
script/convert_mesh.py
Python
bsd-3-clause
10,146
[ "VTK" ]
bf2ffbdae8f413890731c9a599c52799f62031a39e63cefd946af228583eace3
""" Datasets to be used in the docs and tests. Most of the datasets are adapted from the R ismev package. For more information visit: http://cran.r-project.org/web/packages/ismev/index.html Other datasets includes: -harris1996 - Annual maximum wind speeds used in Harris (1996), "Gumbel re-visited - a new look at ext...
kikocorreoso/scikit-extremes
skextremes/datasets/datasets.py
Python
mit
12,081
[ "VisIt" ]
e52b4b22f35bb6663f88ff8a64b10585745c6dc9b5a2f9a3ea545cbcfb42c05d
# autofragment.py import pandas as pd import pdb import json from rdkit import Chem def count_substructures(radius,molecule): """Helper function for get the information of molecular signature of a metabolite. The relaxed signature requires the number of each substructure to construct a matrix for each mole...
almut-heinken/cobratoolbox
src/analysis/thermo/groupContribution/wang/autofragment.py
Python
gpl-3.0
2,126
[ "RDKit" ]
a4bbd79bfb5ab7fba54f90eae8a09eb709f976d13e0aa79648d3c3ab8740e9de
import numpy as np from geometric.molecule import Molecule import os, subprocess, copy def check_all_float(iterable): try: [float(i) for i in iterable] return True except: return False class QMEngine(object): def __init__(self, input_file=None, work_queue=None, native_opt=False): ...
leeping/crank
crank/QMEngine.py
Python
mit
19,838
[ "Psi4", "TeraChem" ]
27f98782ad08ebd5c99cc396861fbec3b768fd850ce25377b09cfe901c48e353
# -*- 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...
Fedik/gramps
gramps/plugins/webreport/basepage.py
Python
gpl-2.0
142,194
[ "Brian" ]
97b6e1ed11e385dd424d47c2a47d73105645459fab4442e14df9d372f5c53e7d
# # Copyright 2018 Analytics Zoo Authors. # # 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...
intel-analytics/analytics-zoo
pyzoo/zoo/examples/orca/learn/openvino/predict.py
Python
apache-2.0
3,611
[ "ORCA" ]
2e6680baf8b187657fcd43ad8096c771d8b1f76dbd2ff367bf9e549fbd3bf62a
""" ../wps.py?request=execute &service=wps &version=1.0.0 &identifier=esmvaltool-perfmetrics &status=true &storeExecuteResponse=true """ import datetime import shutil import netCDF4 import urlparse from pywps.Process import WPSProcess import os import logging from jinja2 import FileSystemLoader, Environment,select...
c3s-magic/adaguc-services-esmvaltool-wps
processes/esmvaltool-clouds-ipcc.py
Python
apache-2.0
9,095
[ "NetCDF" ]
b4fb7594bc7fc4257650742fe3b2514175277c98ec4584eaf1e7fa09cca323ce
"""Input and output of DCD/DVD trajectory files. See http://www.ks.uiuc.edu/Research/vmd/plugins/molfile/dcdplugin.html for a specification of the file format. """ __all__ = ['DCDReader', 'DVDReader'] import struct from io import BytesIO import numpy as np # XXX Deal with endianness in DCD files. # XXX Accelera...
clsb/miles
miles/dcdreader.py
Python
mit
3,701
[ "VMD" ]
0867c9419eb544a9b880de27bab55ac1afa97f2a266c239d7f9a79dc8727561d
#!/usr/bin/env python3 """ Copyright 2020 Paul Willworth <ioscode@gmail.com> This file is part of Galaxy Harvester. Galaxy Harvester 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, either version 3 ...
pwillworth/galaxyharvester
html/ghObjectSchematic.py
Python
gpl-3.0
3,435
[ "Galaxy" ]
3327c6815aa9467aa424fd58a08a153e02d994bb283335c730a69a7b9ce48bf8
import numpy as np from ase.build import bulk from ase.calculators.emt import EMT from ase.io import write from hiphive import ClusterSpace, ForceConstantPotential, StructureContainer from hiphive.calculators import ForceConstantCalculator from hiphive.input_output.gpumd import write_r0 from hiphive.utilities import ...
brucefan1983/GPUMD
potentials/fcp/Al/make_gpumd_files.py
Python
gpl-3.0
1,434
[ "ASE", "GPUMD" ]
2e7a0f90276d5522f569e2775005c2b90bd8a07b9062d6b2c56b7f666c22fda1
import click from parsec.cli import pass_context, json_loads from parsec.decorators import custom_exception, json_output @click.command('create_remote_user') @click.argument("user_email", type=str) @pass_context @custom_exception @json_output def cli(ctx, user_email): """Create a new Galaxy remote user. Output: ...
galaxy-iuc/parsec
parsec/commands/users/create_remote_user.py
Python
apache-2.0
447
[ "Galaxy" ]
a62ac45e19ef8ec91eb5fb8a16e522fc618ff9421bd2c4121d7dc4d177fa21a8
# (c) 2012, Michael DeHaan <michael.dehaan@gmail.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, either version 3 of the License, or # (at your option) any lat...
gnosek/ansible
lib/ansible/color.py
Python
gpl-3.0
1,957
[ "Brian" ]
78fd0aa0845e15149ef790d2be9f19b49d453a858c48e2a5121cce2e8b8555c7
# class generated by DeVIDE::createDeVIDEModuleFromVTKObject from module_kits.vtk_kit.mixins import SimpleVTKClassModuleBase import vtk class vtkGraphHierarchicalBundle(SimpleVTKClassModuleBase): def __init__(self, module_manager): SimpleVTKClassModuleBase.__init__( self, module_manager, ...
nagyistoce/devide
modules/vtk_basic/vtkGraphHierarchicalBundle.py
Python
bsd-3-clause
522
[ "VTK" ]
3d8d999cdb58e1a40d6536cd77d9f3517919f5463e35de20a0decb81aefcd5e9
# Author: Engelbert Gruber # Contact: grubert@users.sourceforge.net # Revision: $Revision: 4242 $ # Date: $Date: 2006-01-06 00:28:53 +0100 (Fri, 06 Jan 2006) $ # Copyright: This module has been placed in the public domain. """ LaTeX2e document tree Writer. """ __docformat__ = 'reStructuredText' # code contributions ...
pombreda/django-hotclub
libs/external_libs/docutils-0.4/docutils/writers/latex2e/__init__.py
Python
mit
76,611
[ "VisIt" ]
fb5c7d639c91a23d4e252077f040dbab5f07553c79e15823d18e37d5f7fdcbaf
""" Basic unit tests for the Job API """ __RCSID__ = "$Id$" import StringIO from DIRAC.Interfaces.API.Job import Job from DIRAC.Core.Utilities.ClassAd.ClassAdLight import ClassAd def test_basicJob(): job = Job() job.setOwner('ownerName') job.setOwnerGroup('ownerGroup') job.setName('jobName') job.setJobG...
andresailer/DIRAC
Interfaces/API/test/Test_JobAPI.py
Python
gpl-3.0
2,181
[ "DIRAC" ]
c2ec6140c635593f879f2395b28d245bc1875154cb0b940b9d81a0226ecf6c46
# Copyright 2008, 2009 CAMd # (see accompanying license files for details). """Definition of the Atoms class. This module defines the central object in the ASE package: the Atoms object. """ import warnings from math import cos, sin import numpy as np from ase.atom import Atom from ase.data import atomic_numbers, ...
grhawk/ASE
tools/ase/atoms.py
Python
gpl-2.0
56,053
[ "ASE" ]
33e4a3374cf3f8b138e4b810b55abc15d752e13510ab687278b384854abaa9bd
# ============================================================================ # # Copyright (C) 2007-2012 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...
jeroendierckx/Camelot
camelot/view/controls/action_widget.py
Python
gpl-2.0
18,550
[ "VisIt" ]
80cac74e1cd25592eeb17aa2ab59f356d71e56b9c70b84543f7def210ffdd794
# Orca # # Copyright (C) 2013-2014 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; either # version 2.1 of the License, or (...
GNOME/orca
src/orca/scripts/toolkits/gtk/script_utilities.py
Python
lgpl-2.1
8,181
[ "ORCA" ]
8b1edb5e2b446cb9ddd8b56ea82bf9ed3536ede84b0828718f2d8995887cd54d
#!/usr/bin/env python # -*- coding: utf-8 -*- from __future__ import division import os import hashlib import datetime from binascii import hexlify, unhexlify try: ModuleNotFoundError except: ModuleNotFoundError = ImportError try: from .hexhashes import * from .base58 import * from .miscfuncs im...
maxweisspoker/simplebitcoinfuncs
simplebitcoinfuncs/electrum1.py
Python
mit
22,272
[ "CRYSTAL", "VisIt" ]
8c7e8fb1c996fefbc3679bcd0bff039a7e62a451efe1bfb9ae8da5681cc3c982
""" @author: Bohdan Mushkevych @author: Brian Curtin http://code.activestate.com/lists/python-ideas/8982/ """ import numbers import threading from datetime import datetime, timedelta class RepeatTimer(threading.Thread): """ This class triggers every number of seconds """ def __init__(self, interval, call_back...
mushkevych/scheduler
synergy/system/repeat_timer.py
Python
bsd-3-clause
2,859
[ "Brian" ]
a619605ca92314e0bbeab4092d24154d77fe39f98dee98618057fee80180cc16
"""Leetcode 559. Maximum Depth of N-ary Tree Easy URL: https://leetcode.com/problems/maximum-depth-of-n-ary-tree/ Given a n-ary tree, find its maximum depth. The maximum depth is the number of nodes along the longest path from the root node down to the farthest leaf node. For example, given a 3-ary tree: 1 ...
bowen0701/algorithms_data_structures
lc0559_maximum_depth_of_n-ary_tree.py
Python
bsd-2-clause
2,435
[ "VisIt" ]
1c87efdf89f9b477f07d6bc47e706dd070c9a582dd265d38b9fb82c6eea0626d
r"""OS routines for Mac, NT, or Posix depending on what system we're on. This exports: - all functions from posix, nt, os2, or ce, e.g. unlink, stat, etc. - os.path is one of the modules posixpath, or ntpath - os.name is 'posix', 'nt', 'os2', 'ce' or 'riscos' - os.curdir is a string representing the current di...
huran2014/huran.github.io
wot_gateway/usr/lib/python2.7/os.py
Python
gpl-2.0
25,769
[ "VisIt" ]
ea0eab1f599a94fcdd4b64d09b0a0b68381d39695f27a511ce0c507b4f011a3e
import os import glob import subprocess import commands import numpy as np import matplotlib.pyplot as plt import matplotlib from matplotlib.ticker import AutoMinorLocator from dophot import * from findSN import * from astropy.time import Time from moon import * import csv import sys sys.path.insert(0, '/home/afsari/')...
niliafsari/KSP-SN
Gemini_spectra.py
Python
bsd-3-clause
7,660
[ "Galaxy" ]
7e117902423d5789e390f836427f15bca57f910199581ccff90765bdf5665b98
# coding=utf-8 # Copyright 2014 Pants project contributors (see CONTRIBUTORS.md). # Licensed under the Apache License, Version 2.0 (see LICENSE). from __future__ import (absolute_import, division, generators, nested_scopes, print_function, unicode_literals, with_statement) from textwrap import...
slyphon/pants
tests/python/pants_test/targets/test_wiki_page.py
Python
apache-2.0
3,065
[ "exciting" ]
5e005150fb4245d54fc177caf22794b58469c6c334ef5f4c235f955450006166
from __future__ import division from __future__ import print_function #!/usr/bin/python # program to plot SEVIRI observations # usage from command line # $ python plot_msg.py # # pass arguments to overwrite time, rgb, area given in the script # $ python plot_msg.py year month day hour min rgb area # year mont...
meteoswiss-mdr/monti-pytroll
scripts/plot_ci.py
Python
lgpl-3.0
33,454
[ "NetCDF" ]
141de005c590d5f18766ef2a081a8693513ec89396004a0a5ec3801eba315103
# This is the instrument-specific file for the PS3000a series of instruments. # # pico-python is Copyright (c) 2013-2014 By: # Colin O'Flynn <coflynn@newae.com> # Mark Harfouche <mark.harfouche@gmail.com> # All rights reserved. # # Redistribution and use in source and binary forms, with or without # modification, are p...
haymeister/pico-python
picoscope/ps3000a.py
Python
bsd-2-clause
16,340
[ "Gaussian" ]
c2a9effede933b2769de424b088e98ec8b780a436cecdb870729e1998407f573
#!/usr/bin/env python import sys import keyword import os import subprocess import tempfile import shutil import fnmatch import re import hashlib import appdirs import cffi import pycparser import pycparser.c_generator from cffi import FFI from glob import glob from itertools import chain from collections import defau...
revng/llvmcpy
llvmcpy/llvm.py
Python
mit
31,392
[ "VisIt" ]
1b26793cfe87b116217fc8cf54713e3120bc8d28b7e11d76273dcc04c0d7d67a
import pylab as pyl import cPickle as pickle galaxies = pickle.load(open('galaxies.pickle','rb')) galaxies = filter(lambda galaxy: galaxy.ston_I >30. and galaxy.Color_grad != None, galaxies) f1 = pyl.figure(1, figsize=(6,4)) f1s1 = f1.add_subplot(111) icd = pyl.asarray([galaxy.ICD_IH*100 for galaxy in galaxi...
boada/ICD
sandbox/plot_icd_colorgrad.py
Python
mit
947
[ "Galaxy" ]
4e073c80e0300c0eae3f899e969d9d192832af16eac853a7631239a98a994289
# coding: utf-8 from __future__ import division, unicode_literals """ This module defines the VaspInputSet abstract base class and a concrete implementation for the parameters used by the Materials Project and the MIT high throughput project. The basic concept behind an input set is to specify a scheme to generate a...
Dioptas/pymatgen
pymatgen/io/vaspio_set.py
Python
mit
62,648
[ "VASP", "pymatgen" ]
633eafe2cf56f57c839873b5d8a2d0ed4be6e03a1510d0dc0e54a00efd8aaed2
######################################################################## # File : StatesAccountingAgent.py # Author : A.T. ######################################################################## """ StatesAccountingAgent sends periodically numbers of jobs in various states for various sites to the Monitorin...
vmendez/DIRAC
WorkloadManagementSystem/Agent/StatesAccountingAgent.py
Python
gpl-3.0
5,569
[ "DIRAC" ]
162b93ea845b5741121b9bece035aec521fb476d85a4b75a78c192a1c14a5f1b
import sys import os import commands import nipype.pipeline.engine as pe import nipype.algorithms.rapidart as ra import nipype.interfaces.fsl as fsl import nipype.interfaces.io as nio import nipype.interfaces.utility as util from utils import * from CPAC.vmhc import * from nipype.interfaces.afni import preprocess from ...
sgiavasis/C-PAC
CPAC/vmhc/vmhc.py
Python
bsd-3-clause
22,733
[ "Gaussian" ]
fcdf82544507c9ae001e92134ee3891b08d93ec5a096177454c0c028e78edb7e
''' ResourceStatusClient Client to interact with the ResourceStatusDB. ''' #pylint: disable=unused-argument from DIRAC import S_OK from DIRAC.Core.DISET.RPCClient import RPCClient from DIRAC.ResourceStatusSystem.Utilities ...
Andrew-McNab-UK/DIRAC
ResourceStatusSystem/Client/ResourceStatusClient.py
Python
gpl-3.0
15,310
[ "DIRAC" ]
a22f444066575acf5a521ba7dbb763587e1d5390c37be5227189edcb7dd76437
# Copyright (C) 2015 Henrique Pereira Coutada Miranda, Alejandro Molina Sanchez # All rights reserved. # # This file is part of yambopy # # from qepy import * import os import re from math import sqrt class PwIn(): """ Class to generate an manipulate Quantum Espresso input files Can be initialized either r...
palful/yambopy
qepy/pw.py
Python
bsd-3-clause
12,245
[ "ASE", "CRYSTAL", "Quantum ESPRESSO" ]
f8efccd2ad1a208a8dc6bae51f4230f07bbd4f307a8d56af4c26893d1278a7cf
""" Physical units and dimensions. The base class is Unit, where all here defined units (~200) inherit from. The find_unit function can help you find units for a given quantity: >>> import sympy.physics.units as u >>> u.find_unit('coul') ['coulomb', 'coulombs'] >>> u.find_unit(u.charge) ['C', 'ch...
mafiya69/sympy
sympy/physics/units.py
Python
bsd-3-clause
8,610
[ "Avogadro" ]
75aeccad3dc662a0fe7278bac3ec658997b8c2680646ecd091c3ab33f598baf8