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from openmm_systems.test_systems import LennardJonesPair import simtk.openmm.app as omma import simtk.openmm as omm import simtk.unit as unit from wepy.runners.openmm import gen_sim_state import time import trio def create_sim(): test_sys = LennardJonesPair() integrator = omm.LangevinIntegrator(300.0*unit...
ADicksonLab/wepy
jigs/trio_mapper/source/trio_openmm.py
Python
mit
1,420
[ "OpenMM" ]
bcc69289f6d99074b192b6c803db730994e5cfbd4405050a7986779ecc3ca8fc
"""Support for the Amazon Polly text to speech service.""" import logging import boto3 import voluptuous as vol from homeassistant.components.tts import PLATFORM_SCHEMA, Provider import homeassistant.helpers.config_validation as cv _LOGGER = logging.getLogger(__name__) CONF_REGION = "region_name" CONF_ACCESS_KEY_ID...
joopert/home-assistant
homeassistant/components/amazon_polly/tts.py
Python
apache-2.0
6,945
[ "Brian" ]
1aa765855a9fded5b3e1d70c149a5ce5dffb0147eefaeb06633143f6597f0919
#!/usr/bin/env python3 # -*- coding: utf-8 -*- # Copyright 2017--2018 Amazon.com, Inc. or its affiliates. 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. A copy of the License # is located at # # http://aws....
mlperf/training_results_v0.7
Google/benchmarks/gnmt/implementations/gnmt-research-TF-tpu-v4-512/utils/sacrebleu.py
Python
apache-2.0
96,093
[ "COLUMBUS" ]
4c0c49f8feee4a8c93bd5b6e81c0b311b6cfb4ee280d3ca02834efb873367da1
""" Job Base Class This class provides generic job definition functionality suitable for any VO. Helper functions are documented with example usage for the DIRAC API. An example script (for a simple executable) would be:: from DIRAC.Interfaces.API.Dirac import Dirac from DIRAC.Interfaces.API.J...
fstagni/DIRAC
Interfaces/API/Job.py
Python
gpl-3.0
49,591
[ "DIRAC" ]
a386659c9c9e3ad7aef8e9ae39d9de0d1783f7bb13af42d199c6802b1e9afef9
data = ( 'mya', # 0x00 'myag', # 0x01 'myagg', # 0x02 'myags', # 0x03 'myan', # 0x04 'myanj', # 0x05 'myanh', # 0x06 'myad', # 0x07 'myal', # 0x08 'myalg', # 0x09 'myalm', # 0x0a 'myalb', # 0x0b 'myals', # 0x0c 'myalt', # 0x0d 'myalp', # 0x0e 'myalh', # 0x0f 'myam', # ...
samuelmaudo/yepes
yepes/utils/unidecode/x0ba.py
Python
bsd-3-clause
4,765
[ "MOE" ]
e20b9b89fa01789514af05c4238962b49ca07a4b9f1327265832eb27e42fb35e
""" Wrapper for gaussian filter that supports padding of the boundary with voxel values inside the brain boundary. The purpose of padding is so that gaussian filter results are not distorted too badly nearly the brain boundary because of the extremely low fMRI measurements outside the brain boundary. """ import sys, o...
nhejazi/project-gamma
code/utils/gaussian_filter.py
Python
bsd-3-clause
1,482
[ "Gaussian" ]
0b1d547adf5818e204a8f258e5833f825da26b2c3ca4f3348a7d5e11428a0ce4
#poly_gauss_coil model #conversion of Poly_GaussCoil.py #converted by Steve King, Mar 2016 r""" This empirical model describes the scattering from *polydisperse* polymer chains in theta solvents or polymer melts, assuming a Schulz-Zimm type molecular weight distribution. To describe the scattering from *monodisperse* ...
SasView/sasmodels
sasmodels/models/poly_gauss_coil.py
Python
bsd-3-clause
4,158
[ "Avogadro" ]
c2d03dbb251ecc876fce968e138b3f6d581c32b7140a38d02013db614d3535cd
# 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 applicable law or agreed to in writing, ...
brianinnes/vPiP
python/vPiP/generators/__init__.py
Python
apache-2.0
612
[ "Brian" ]
49c484484269ade89d476e59c562cf909342b2767919d81f17e2653120d40fc4
"""Participation model tests.""" from django.db.utils import IntegrityError from tests.utils import ModelTestCase from users.factory import UserFactory from visits.factory import VisitFactory from visits.models import Participation class ParticipationTest(ModelTestCase): """Test the Participation model.""" ...
oser-cs/oser-website
tests/test_visits/test_participation.py
Python
gpl-3.0
1,554
[ "VisIt" ]
0b45d7392b19fbcb7d30ab8580499d8a0541c581069e60d2e5b4895d3491798b
# Compute a particle concentration # and save as netCDF import datetime import numpy as np from netCDF4 import Dataset from postladim import ParticleFile # import gridmap # ---------------- # User settings # ---------------- particle_file = "/hexagon/vol1/bjorn_rhea/out.nc" grid_file = "/data/model_data006/anneds/...
bjornaa/ladim
models/zladim/aggregate2nc.py
Python
mit
2,622
[ "NetCDF" ]
e40158e2d8018b9b7ac88c2e8d5341e92c83ba32a728fb27b64e0d950063795b
from django.contrib import admin from .models import APIKey, Short, Visit class APIKeyAdmin(admin.ModelAdmin): list_display = ('user', 'key', ) model = APIKey class VisitAdmin(admin.TabularInline): extra = 0 model = Visit readonly_fields = ('remote_addr', 'user_agent', 'referrer', 'created_at',...
sneeu/little
little/admin.py
Python
mit
733
[ "VisIt" ]
901fc3c1f2d016b7d10ed34008df191931e3a0dbbe14501f5ccca5dfbd6b2fef
""" This Module is the graphic user interface wrapper for accessing the all small molecules database Current Problems: Compatibility issues and quick fix: Issues with upgraded version of matplotlib: for ubuntu: sudo apt-get install tk-dev libpng-dev libffi-dev dvipng texlive-...
azariven/BioSig_SEAS
SEAS_Aux/Visualizer/Spec_Gui.py
Python
gpl-3.0
24,054
[ "RDKit" ]
8bdaac6f0bd6e1a35073cc78c522201769b62e3fc499e385d89cb1caf3e33b6d
# -*- coding: utf-8 -*- """Release data for the IPython project.""" #----------------------------------------------------------------------------- # Copyright (c) 2008, IPython Development Team. # Copyright (c) 2001, Fernando Perez <fernando.perez@colorado.edu> # Copyright (c) 2001, Janko Hauser <jhauser@zscout.de>...
lmregus/Portfolio
python/design_patterns/env/lib/python3.7/site-packages/IPython/core/release.py
Python
mit
4,272
[ "Brian" ]
f211e085d581e7690cf91c4b1aa54f2e867fd0d199dd27f4242cec29d92ab111
#!/usr/bin/env python # # SPDX-FileCopyrightText: 2014-2022 Fredrik Ahlberg, Angus Gratton, Espressif Systems (Shanghai) CO LTD, other contributors as noted. # # SPDX-License-Identifier: GPL-2.0-or-later from __future__ import division, print_function import argparse import base64 import binascii import copy import h...
espressif/esptool
esptool.py
Python
gpl-2.0
267,470
[ "CRYSTAL", "VisIt" ]
59816efb6fbf9ed7d8565bc9fa6ce9d79e832045b0c0f1b16d9f164b15953609
#__docformat__ = "restructuredtext en" # ******NOTICE*************** # optimize.py module by Travis E. Oliphant # # You may copy and use this module as you see fit with no # guarantee implied provided you keep this notice in all copies. # *****END NOTICE************ # A collection of optimization algorithms. Version ...
apbard/scipy
scipy/optimize/optimize.py
Python
bsd-3-clause
105,325
[ "Gaussian" ]
449ebb2732985aeba73009354b48af4f364d9845274a5db359f92635718b07ac
################################################################## ## This program is part of 'MOOSE', the ## Messaging Object Oriented Simulation Environment. ## Copyright (C) 2015 Upinder S. Bhalla. and NCBS ## It is made available under the terms of the ## GNU Lesser General Public License version 2.1 ## S...
dilawar/moose-full
moose-examples/snippets/testWigglySpines.py
Python
gpl-2.0
8,167
[ "MOOSE", "NEURON" ]
956d0b26e713208efad287aff69458f062b435d527654754615aa9fc2a54e91d
# SimpleCV Image Object #load required libraries from SimpleCV.base import * from SimpleCV.Color import * from numpy import int32 from numpy import uint8 import pygame as pg class ColorSpace: """ This class is used to encapsulates the color space of a given image. This class acts like C/C++ sty...
intelie/pycollector
src/third/SimpleCV/ImageClass.py
Python
bsd-3-clause
96,392
[ "Gaussian" ]
eb042f52edf4196a6d5f33c783ecc12bfa7d78f93391539c09668388b784686c
# -*- coding: utf-8 -*- # """ ORCA Open Remote Control Application Copyright (C) 2013-2020 Carsten Thielepape Please contact me by : http://www.orca-remote.org/ This program is free software: you can redistribute it and/or modify it under the terms of the GNU General Public License as pu...
thica/ORCA-Remote
src/scripts/system/system_debuglogger/script.py
Python
gpl-3.0
4,025
[ "ORCA" ]
4f1f1025ec8869d0c1a0c3f0437d683e530329c10d7c8ac0358cd437bc8277d8
from abc import ABCMeta, abstractmethod class NeuralViewerConsole(metaclass=ABCMeta): @staticmethod @abstractmethod def show_connection(connection): pass @staticmethod @abstractmethod def show_neuron(neuron): pass @staticmethod @abstractmethod def show_neural_netw...
mcasl/AMORE
pyAmore/cython/viewers.py
Python
gpl-3.0
3,229
[ "NEURON" ]
c7983b09e3dd8f203b324a8138bb08355cb9340ad7117a1b78bd5e513f81a595
# -*- coding: utf-8 -*- from __future__ import absolute_import from __future__ import division from __future__ import print_function from __future__ import unicode_literals import numpy as np from .math import fit_gaussian import warnings from scipy.ndimage import center_of_mass, shift from scipy.optimize import minim...
DanHickstein/pyBASEX
abel/tools/center.py
Python
gpl-2.0
23,101
[ "Gaussian" ]
93c263212a3535e5fed6c24e3167a47aff209aa1acabee125d3d9118ae6f3f08
import pytest from pysisyphus.calculators.AnaPot import AnaPot from pysisyphus.helpers import geom_loader from pysisyphus.optimizers.LBFGS import LBFGS from pysisyphus.testing import using from pysisyphus.calculators.PySCF import PySCF @pytest.mark.skip @using("pyscf") @pytest.mark.parametrize("line_search", [True, ...
eljost/pysisyphus
tests/test_lbfgs/test_lbfgs.py
Python
gpl-3.0
1,871
[ "PySCF" ]
d2b53e75428bef8ee378bf7751d69a88cee62d7aec4006fc6fe4a7a27657df23
"""Core visualization operations.""" # Authors: Alexandre Gramfort <alexandre.gramfort@inria.fr> # Eric Larson <larson.eric.d@gmail.com> # Joan Massich <mailsik@gmail.com> # Guillaume Favelier <guillaume.favelier@gmail.com> # # License: Simplified BSD import sys import os from contextlib im...
bloyl/mne-python
mne/viz/backends/renderer.py
Python
bsd-3-clause
12,076
[ "Mayavi" ]
e587f3fec53c28abe34f8bd953b40141031cf1c6f6d0882d97648a63cba5a7c5
# MP1 Application 1 # Brian T. Bailey # Define get and put functions def get(list): t = list.pop(0) print "Removed a task from the queue: %s with priority %s" % (t.keys()[0], t[t.keys()[0]]) return t def put(list, task): list.append(task) list.sort(key=lambda pv: pv.values()[0], reverse=True) print "Added...
briantbailey/ITM-513
mp1/mp1_app1.py
Python
mit
1,442
[ "Brian" ]
f680b9a4915303e9195d18a135623cac5400b0483877cbae800e3b55c0eb313b
#!/usr/bin/python2 # # Copyright (c) 2017 nexB Inc. and others. All rights reserved. # http://nexb.com and https://github.com/nexB/scancode-toolkit/ # The ScanCode software is licensed under the Apache License version 2.0. # Data generated with ScanCode require an acknowledgment. # ScanCode is a trademark of nexB Inc. ...
yasharmaster/scancode-toolkit
etc/scripts/json2csv.py
Python
apache-2.0
9,466
[ "VisIt" ]
b126380be39733bc3e890871ec84736e0e341bbb8cc3a29340c89e06438c68b9
import StringIO from volatility.renderers.basic import Renderer try: import ujson as json except ImportError: import json __author__ = 'mike' # additional author Tran Vien Ha class HTMLRenderer(Renderer): def __init__(self): pass def render(self, outfd, data): """Renders the treegri...
tranvienha/volatility-osint
misc/html.py
Python
gpl-3.0
5,971
[ "VisIt" ]
d6eba921f0bb1fa9c094dff65d436b86e4a32fae44ec805e6dd7ce81aec9049b
# -*- coding: utf-8 -*- ## Description: class MorphML for loading MorphML from file or xml element into MOOSE ## Version 1.0 by Aditya Gilra, NCBS, Bangalore, India, 2011 for serial MOOSE ## Version 1.5 by Niraj Dudani, NCBS, Bangalore, India, 2012, ported to parallel MOOSE ## Version 1.6 by Aditya Gilra, NCBS, Bangalo...
dilawar/moose-core
python/moose/neuroml/MorphML.py
Python
gpl-3.0
40,827
[ "MOOSE", "NEURON" ]
0a628dba77697715700ba214ccb2ebbe42ed9c0741b356a3fecdb89501b8800c
# -*- Mode: python; tab-width: 4; indent-tabs-mode:nil; coding:utf-8 -*- # vim: tabstop=4 expandtab shiftwidth=4 softtabstop=4 # # MDAnalysis --- http://www.mdanalysis.org # Copyright (c) 2006-2016 The MDAnalysis Development Team and contributors # (see the file AUTHORS for the full list of names) # # Released under t...
kain88-de/mdanalysis
package/MDAnalysis/exceptions.py
Python
gpl-2.0
2,321
[ "MDAnalysis" ]
6d45149badebd6d03f124dc84d93abfb3eedf6a6a893494de46aa9e414e13302
# ---------------------------------------------------------------------------- # 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. # --------------------------------------------...
Kleptobismol/scikit-bio
skbio/tree/tests/test_tree.py
Python
bsd-3-clause
51,540
[ "scikit-bio" ]
0e38e47914d4a8e0902d2d019ab6008ba26535cabf397cf3bb5b9fcc050acbe9
import difflib from test.test_support import run_unittest, findfile import unittest import doctest import sys class TestWithAscii(unittest.TestCase): def test_one_insert(self): sm = difflib.SequenceMatcher(None, 'b' * 100, 'a' + 'b' * 100) self.assertAlmostEqual(sm.ratio(), 0.995, places=3) ...
HiSPARC/station-software
user/python/Lib/test/test_difflib.py
Python
gpl-3.0
11,497
[ "MOOSE" ]
11224893850d5318135dae6f0b7d62121f72d1bd03224b6a881daf25ba34c3fb
######################################################################## # $HeadURL$ ######################################################################## """ Utilities to execute a function with a given proxy. executeWithUserProxy decorator example usage:: @executeWithUserProxy def testFcn( x, i, kw = 'qwerty...
marcelovilaca/DIRAC
Core/Utilities/Proxy.py
Python
gpl-3.0
3,866
[ "DIRAC" ]
d31f51915ae87464768017b8c25f7e972d03500e5d59c7e11a4cff23bde6369f
############################################################################## # 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...
skosukhin/spack
var/spack/repos/builtin/packages/bowtie/package.py
Python
lgpl-2.1
2,175
[ "Bowtie" ]
84cc96f76a81275251ef8cee28dfd3c972f41510d290c67c385ee31e5bb78cf3
# # Gramps - a GTK+/GNOME based genealogy program # # Copyright (C) 2000-2006 Donald N. Allingham # Copyright (C) 2007-2009 Brian G. Matherly # Copyright (C) 2009 Gary Burton # Copyright (C) 2010 Peter Landgren # Copyright (C) 2011 Adam Stein <adam@csh.rit.edu> # # This program is free software; you...
beernarrd/gramps
gramps/plugins/docgen/rtfdoc.py
Python
gpl-2.0
21,776
[ "Brian" ]
a4ed9e0a1cdc112f3dfbb7d579142eb17aa14c6e2a1d79a24772f5cffb5a5e04
import numpy as np from mesonh_atm.mesonh_atmosphere import MesoNHAtmosphere import matplotlib.pyplot as plt from scipy.interpolate import RegularGridInterpolator import scipy.optimize as sciopt import modules.cloud as ModCloud import pickle font = {'size' : 26} plt.rc('font', **font) #Data without advection path ...
DiegoSelle/master_thesis
radial_variograms.py
Python
mit
18,921
[ "Gaussian" ]
9454b8143df5e844e64667767fd2944581496c7ccc41e5e818dfa73ae0200849
#! /usr/bin/env python """ Script to pre-average data using a sliding Gaussian kernel in time """ import argparse from argparse import RawTextHelpFormatter import numpy as np import glob import sys import os import itertools import pickle from scipy.ndimage.filters import gaussian_filter1d as gfilter import casacore.ta...
darafferty/factor
factor/scripts/pre_average_time.py
Python
gpl-2.0
17,676
[ "Gaussian" ]
d97cea1b7da904008334f36a975b8743503f109463dd2e7476e8bbecdbb02fc7
# # linter.py # Linter for SublimeLinter version 4. # # Written by Brian Schott (Hackerpilot) # Copyright © 2014-2019 Economic Modeling Specialists, Intl. # # License: MIT # """This module exports the D-Scanner plugin class.""" from SublimeLinter.lint import Linter, STREAM_STDOUT class Dscanner(Linter): """Pro...
economicmodeling/SublimeLinter-dscanner
linter.py
Python
mit
649
[ "Brian" ]
f582b63e868de58784578fa49bd48244e4abccf12af73a44f649a7f3bd2e229a
#!/usr/bin/env python """Module for the reciprocal blast step.""" from shared import create_directory, concatenate from versions import MAKEBLASTDB, BLASTN, BLASTP from subprocess import check_call, STDOUT import logging as log import os import tempfile import shutil __author__ = "Tim te Beek" __copyright__ = "Copyri...
ODoSE/odose.nl
reciprocal_blast_local.py
Python
mit
2,955
[ "BLAST" ]
7a126b72f19aafab9cff6a71a94277a55a0f150ae3e37589944aed3f1cb904bc
"""Copyright 2012 Phidgets Inc. This work is licensed under the Creative Commons Attribution 2.5 Canada License. To view a copy of this license, visit http://creativecommons.org/licenses/by/2.5/ca/ """ __author__ = 'Adam Stelmack' __version__ = '2.1.8' __date__ = 'May 17 2010' import threading from ctypes ...
danielsuo/mobot
src/move/PhidgetsPython/Phidgets/Devices/Spatial.py
Python
mit
25,537
[ "VisIt" ]
a7b25f375048f5596f208b0b2627061c855f8a25a8b6568a559ccbe351b34e1c
import HTMLParser import json import random import re import urllib2 import urlparse import requests,os,time import xbmc,xbmcaddon USERDATA_PATH = xbmc.translatePath('special://home/userdata/addon_data') ADDON_DATA = os.path.join(USERDATA_PATH,'script.module.universalscrapers') full_file = ADDON_DATA + '/Log.txt' def ...
repotvsupertuga/tvsupertuga.repository
script.module.universalscrapers/lib/universalscrapers/common.py
Python
gpl-2.0
16,257
[ "MOE" ]
10f974eadd9ea597d91fe3de16032e9e90c69eff4f1cc7f0f68401c75c7c7c52
import mdtraj as md import numpy as np import tensorflow as tf import tftraj.rmsd def test_against_mdtraj_diff_xy(sess, traj): inds = [5, 19, 234] target = np.array(traj.xyz[inds]) frames = tf.constant(traj.xyz) target = tf.constant(target) prmsd = tftraj.rmsd.pairwise_msd(frames, target) re...
mdtraj/tftraj
tests/test_rmsd_tf.py
Python
mit
554
[ "MDTraj" ]
62254dc53c51e153c6333139a003610d16300b76183878f3b1439920aa38c440
""" ======================================================= Reading an inverse operator and view source space in 3D ======================================================= """ # Author: Alexandre Gramfort <alexandre.gramfort@telecom-paristech.fr> # # License: BSD (3-clause) print(__doc__) from mne.datasets import sam...
effigies/mne-python
examples/inverse/plot_read_inverse.py
Python
bsd-3-clause
1,462
[ "Mayavi" ]
4850b95114eafcf9e912911cb1746c8f609f978b095068a76871d0b347e50928
#!/usr/bin/env python # -*- coding: utf-8 -*- import os import os.path as op import sys import re import logging from astropy.table import Table, Column from maize.apps.base import AttrDict, str2bool, eprint, sh, mkdir, which from maize.formats.base import must_open from maize.formats.pbs import PbsJob, create_job_ch...
orionzhou/robin
old/pipelines/rnaseq.py
Python
gpl-2.0
24,757
[ "ASE", "BWA", "Bowtie", "HTSeq", "pysam" ]
24c7a230e7e92f9999cc30c7df2d4e2608e338eecb674579fa77912beacf08bc
""" Functions to operate on polynomials. """ from __future__ import division, absolute_import, print_function __all__ = ['poly', 'roots', 'polyint', 'polyder', 'polyadd', 'polysub', 'polymul', 'polydiv', 'polyval', 'poly1d', 'polyfit', 'RankWarning'] import functools import re import warnings i...
ryfeus/lambda-packs
pytorch/source/numpy/lib/polynomial.py
Python
mit
40,292
[ "Gaussian" ]
1a6f9722f6a5252d81d4a311bf205d7738961ed77c6429967f166527490e8b27
#!/usr/bin/env python from opsimsummary import summarize_opsim as oss import matplotlib.pyplot as plt import os import numpy as np import copy from astropy.table import Table from astropy.units import Unit import sncosmo from lsst.sims.photUtils import BandpassDict from lsst.sims.catUtils.supernovae import SNObject ...
rbiswas4/Cadence
quality/metrics.py
Python
mit
9,758
[ "VisIt" ]
573f5a620c58f748bf1a1ffb270c1578c2bc9405553f63c322db240a264717c1
""" Models for the shopping cart and assorted purchase types """ from collections import namedtuple from datetime import datetime from datetime import timedelta from decimal import Decimal import json import analytics from io import BytesIO import pytz import logging import smtplib import StringIO import csv from boto...
vismartltd/edx-platform
lms/djangoapps/shoppingcart/models.py
Python
agpl-3.0
83,588
[ "VisIt" ]
4316d3ae4a5afee22a50b741e52bb32c1a34fa3e4cf36a68228a3019ac3a47a6
# Copyright (C) 2012,2013 # Max Planck Institute for Polymer Research # Copyright (C) 2008,2009,2010,2011 # Max-Planck-Institute for Polymer Research & Fraunhofer SCAI # # This file is part of ESPResSo++. # # ESPResSo++ is free software: you can redistribute it and/or modify # it under the terms of t...
BackupTheBerlios/espressopp
src/integrator/MDIntegrator.py
Python
gpl-3.0
2,056
[ "ESPResSo" ]
3f2abc0bf80a8eaa6f1a7001a674ee8727d0788121aaa1a1cc5dec3f93dec491
# A simple CLI runner for slurm that can be used when running Galaxy from a # non-submit host and using a Slurm cluster. from logging import getLogger try: from galaxy.model import Job job_states = Job.states except ImportError: # Not in Galaxy, map Galaxy job states to Pulsar ones. from pulsar.util im...
natefoo/pulsar
pulsar/managers/util/cli/job/slurm.py
Python
apache-2.0
2,937
[ "Galaxy" ]
08a3c197fab5fdf488b1063ac0acc23dc14e24244e458a458327fb4155dba486
# Copyright (c) 2015, Riverbank Computing Limited # All rights reserved. # # Redistribution and use in source and binary forms, with or without # modification, are permitted provided that the following conditions are met: # # 1. Redistributions of source code must retain the above copyright notice, # this list of c...
LumPenPacK/NetworkExtractionFromImages
win_build/nefi2_win_amd64_msvc_2015/tools/pyqtdeploy/pyqtdeploy/project/project.py
Python
bsd-2-clause
25,486
[ "VisIt" ]
47426f7435a25aebdf85a93108d9d697c2ec303c7b3764b78ff081a09c117360
#!/usr/bin/env python # This program is free software; you can redistribute it and/or # modify it under the terms of the GNU General Public License # as published by the Free Software Foundation; either version 3 # of the License, or (at your option) any later version. # # This program is distributed in the hope that ...
dmnfarrell/smallrnaseq
smallrnaseq/aligners.py
Python
gpl-3.0
4,322
[ "Bowtie" ]
f548dcae91efd096b8e6b79e4094285c22f1ea87e2f5b114cbccc09bbbd3dd47
from __main__ import vtk, qt, ctk, slicer import LASegmentationResources import PythonQt # # LASegmentationWorkflow # class LASegmentationWorkflow: def __init__(self, parent): parent.title = "LA Segmentation Workflow" parent.categories = ["Cardiac MRI Toolkit"] parent.dependencies = [] ...
carma-center/carma_slicer_extension
LASegmentationWorkflow/LASegmentationWorkflow.py
Python
bsd-2-clause
4,949
[ "VTK" ]
3de4735946ccfa53dc80454549472ac0db9c0223c3af96628548345692226111
# Copyright 2018 Dave Eddy <dave@daveeddy.com> # Permission is hereby granted, free of charge, to any person obtaining a copy of this software and associated documentation files (the "Software"), to deal in the Software without restriction, including without limitation the rights to use, copy, modify, merge, publish, ...
EternityForest/KaithemAutomation
kaithem/src/thirdparty/hardline/gui/colornames.py
Python
gpl-3.0
76,222
[ "Amber", "ESPResSo", "Firefly", "Jaguar" ]
96d2be10a9a2a816d0fe1cabbccd7809d9443c3656d8cabca58b3fbb741d3137
#!/usr/bin/env python ######################################################################## # File : dirac-wms-get-normalized-queue-length.py # Author : Ricardo Graciani ######################################################################## """ Report Normalized CPU length of queue This script was used by the...
ic-hep/DIRAC
src/DIRAC/Interfaces/scripts/dirac_wms_get_normalized_queue_length.py
Python
gpl-3.0
1,365
[ "DIRAC" ]
b7548e86a5050659abe3b5b42933a6868e8e98d6c58995eab8daaa98a3f51d8b
############################################################################## # Copyright (c) 2013-2018, Lawrence Livermore National Security, LLC. # Produced at the Lawrence Livermore National Laboratory. # # This file is part of Spack. # Created by Todd Gamblin, tgamblin@llnl.gov, All rights reserved. # LLNL-CODE-64...
krafczyk/spack
var/spack/repos/builtin/packages/r-genomeinfodb/package.py
Python
lgpl-2.1
2,180
[ "Bioconductor" ]
dee4827020a325d0bbe8fd3643b4f223e55e42e02bd2b1bb4603eba0c7381765
__author__ = 'Brian Wickman' from twitter.common.rpc.finagle.protocol import ( TFinagleProtocol, TFinagleProtocolWithClientId) __all__ = [ 'TFinagleProtocol', 'TFinagleProtocolWithClientId' ]
foursquare/commons-old
src/python/twitter/common/rpc/finagle/__init__.py
Python
apache-2.0
202
[ "Brian" ]
273e4e2163427471e2c45de327a249e262ca60348f49559ad1dde725015f8f38
#!/usr/bin/python # Copyright (C) 2019 Red Hat, Inc. # GNU General Public License v3.0+ (see COPYING or https://www.gnu.org/licenses/gpl-3.0.txt) from __future__ import absolute_import, division, print_function __metaclass__ = type ANSIBLE_METADATA = {'metadata_version': '1.1', 'status': ['preview...
wgwoods/lorax
share/lifted/providers/aws/library/ec2_snapshot_import.py
Python
gpl-2.0
7,425
[ "Brian" ]
2be2130abc819fb32740c957e7edacf37fc9a87b6b4421443422aa5442f268e9
#!/usr/bin/python import sys import misc_utils as utils from Bio import AlignIO ############################# CLASSES ################################## class consensAlign(): 'Consensus alignment object' #Default constructor def __init__(self, alignment, threshold=0.1, mask=0.1): self.alnVars = [] self.conSeq...
tkchafin/fst_filter.py
alignment_tools_v2.py
Python
gpl-3.0
4,675
[ "Biopython" ]
e88b7ac6ba1967bf2d99553982b6e2fc3912a551454a2fe5ac3eb0adb208b63b
# This tests calculates the force on the atoms of a small molecule. # # If the test fails, set the fd boolean below to enable a (costly) finite # difference check. import numpy as np from ase.data.molecules import molecule from gpaw import GPAW from gpaw.atom.basis import BasisMaker obasis = BasisMaker('O').generate(...
qsnake/gpaw
gpaw/test/lcao_force.py
Python
gpl-3.0
1,753
[ "ASE", "GPAW" ]
dc23be2b375f438f04d62f5d4a5f52722387e17ee52dffed3b56984097fa5b65
from __future__ import division, print_function, absolute_import __all__ = ['Sphere', 'HemiSphere', 'faces_from_sphere_vertices', 'unique_edges'] import numpy as np import warnings from ..utils.six.moves import xrange from dipy.core.geometry import cart2sphere, sphere2cart, vector_norm from dipy.core.onetime import...
mdesco/dipy
dipy/core/sphere.py
Python
bsd-3-clause
19,979
[ "Gaussian" ]
fbf145c71a4dcad890d5a207d96908a29c085457ae65fe67a11abd9c93fdcf9c
# Copyright (c) 2014-2016 Genome Research Ltd. # # This file is part of IVA. # # IVA 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. # ...
sanger-pathogens/iva
iva/assembly.py
Python
gpl-3.0
29,056
[ "pysam" ]
e30d8c87d681b08dd6d99c33dba0bfeb8717e23fa37ea712562b7057509957c7
""" Course Outline page in Studio. """ import datetime from bok_choy.javascript import js_defined, wait_for_js from bok_choy.page_object import PageObject from bok_choy.promise import EmptyPromise from selenium.webdriver import ActionChains from selenium.webdriver.common.keys import Keys from selenium.webdriver.suppor...
fintech-circle/edx-platform
common/test/acceptance/pages/studio/overview.py
Python
agpl-3.0
38,571
[ "VisIt" ]
9ad29ac156b7638a5de5c97b35dbddf9a03f1be3e7398eda74a51bb1c440ab94
"""SIESTA calculator interface.""" # Copyright (C) 2015 Henrique Pereira Coutada Miranda # All rights reserved. # # This file is part of phonopy. # # Redistribution and use in source and binary forms, with or without # modification, are permitted provided that the following conditions # are met: # # * Redistributions o...
atztogo/phonopy
phonopy/interface/siesta.py
Python
bsd-3-clause
9,218
[ "CRYSTAL", "SIESTA", "VASP", "phonopy" ]
60303757fc98e749ae68b39ea66c851e07cb061c152fdda6f99e248d0eb2607c
import os import tempfile import numpy as np import tables from mdtraj.testing import eq from msmbuilder3.base import BaseModeller, EstimatorMixin fn = None def setup(): global fn fn = tempfile.mkstemp()[1] def teardown(): os.unlink(fn) class MyEstimator(BaseModeller, EstimatorMixin): def __init__(...
rmcgibbo/msmbuilder3
tests/test_to_from_pytables.py
Python
gpl-3.0
1,495
[ "MDTraj" ]
bff4d622ce9d381e9c38afb8026e37796348c8bd8539fd3140b4ff2b1dee5292
#!/usr/bin/env python # # This example demonstrates how to use multiple renderers within a # render window. It is a variation of the Cone.py example. Please # refer to that example for additional documentation. # import vtk import time # # Next we create an instance of vtkConeSource and set some of its # properties....
b3c/VTK-5.8
Examples/Tutorial/Step3/Python/Cone3.py
Python
bsd-3-clause
2,693
[ "VTK" ]
25d394531c30df76fab6c7f353d4b0177de94574ed6517faadf635e56d156315
"""A base class notebook manager. Authors: * Brian Granger """ #----------------------------------------------------------------------------- # Copyright (C) 2011 The IPython Development Team # # Distributed under the terms of the BSD License. The full license is in # the file COPYING, distributed as part of th...
noslenfa/tdjangorest
uw/lib/python2.7/site-packages/IPython/html/services/notebooks/nbmanager.py
Python
apache-2.0
8,907
[ "Brian" ]
4446e0b50c4021fef1822e96c8d5b79d2b9a406139a08dc6e8d7e3fb8f0ca68b
""" Test the API for Gyms """ from app.tests.api.personalised.gym_gym_visit_collection.gym_visit_common \ import GymVisitAPICommonCase class TestGymVisitCollectionModelData(GymVisitAPICommonCase): """ Test the API methods for the Gym """ def test_gym_visit_list(self): """ Test that a lis...
Gimpneek/exclusive-raid-gym-tracker
app/tests/api/personalised/gym_gym_visit_collection/test_model_data.py
Python
gpl-3.0
1,102
[ "VisIt" ]
0d5ed60f0117c043584d6250664ca4a958449456357fa69d372db75990e28c26
# Copyright 2006 by Tiago Antao <tiagoantao@gmail.com>. 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._py3k import _universal_read_mode import os import unittest fro...
updownlife/multipleK
dependencies/biopython-1.65/Tests/test_PopGen_SimCoal_nodepend.py
Python
gpl-2.0
2,072
[ "Biopython" ]
54fd5f0957de0c41c68147236c093d29b4697b373ab7ab4f1b569374021445f4
""" JobMonitoringHandler is the implementation of the JobMonitoring service in the DISET framework The following methods are available in the Service interface """ from __future__ import print_function __RCSID__ = "$Id$" from datetime import timedelta from DIRAC import S_OK, S_ERROR from DIRAC.Core.DISET.Re...
chaen/DIRAC
WorkloadManagementSystem/Service/JobMonitoringHandler.py
Python
gpl-3.0
20,321
[ "DIRAC" ]
3f306aac8ec93c4b4a58d7c6e6bc5015f7d5fb64ea91e2820e120c44c65ebe2e
#!/usr/bin/env python3 import sys from pathlib import Path import jinja2 import pypandoc import pytoml as toml from common import list_ops, list_mods, validate_toml if (sys.version_info.major, sys.version_info.minor) < (3, 6): raise Exception("need Python 3.6 or later") THIS_FILE = Path(__file__).resolve() ROO...
burnsauce/teletype
utils/docs.py
Python
gpl-2.0
5,376
[ "ORCA" ]
6d6da9834dd69317396b25f13768056de6b62622b7aef7d775b06f3a2d5cd4e4
from ase.structure import molecule from ase.neb import NEB from ase.calculators.emt import EMT from ase.optimize.fire import FIRE as QuasiNewton from ase.visualize import view #Optimise molecule initial = molecule('C2H6') initial.set_calculator(EMT()) relax = QuasiNewton(initial) relax.run(fmax=0.05) view(initial) #C...
misdoro/python-ase
doc/tutorials/neb/idpp2.py
Python
gpl-2.0
777
[ "ASE" ]
552e576a07bd7beb2d90a5857538850773e5ec5b172cb0a44c9b521c632a2f02
# python3 # pylint: disable=g-bad-file-header # Copyright 2021 DeepMind Technologies Limited. 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...
deepmind/neural_testbed
neural_testbed/generative/gp_regression_envlikelihood.py
Python
apache-2.0
4,574
[ "Gaussian" ]
93b2272b9717dbc3ea2e0b520463869c86f3df53fab2105e0da1293cf92c2b56
""" Tests for discussion pages """ import datetime from uuid import uuid4 from nose.plugins.attrib import attr from pytz import UTC from flaky import flaky from common.test.acceptance.tests.discussion.helpers import BaseDiscussionTestCase from common.test.acceptance.tests.helpers import UniqueCourseTest from common....
deepsrijit1105/edx-platform
common/test/acceptance/tests/discussion/test_discussion.py
Python
agpl-3.0
61,938
[ "VisIt" ]
4abb13fd3baa0c3cf23f1ad7145bf028e2714e4cb5b4a512a59ef95a45c73e93
#!/usr/bin/env python2 """ Copyright (C) 2015-2016 Jakub Krajniak <jkrajniak@gmail.com> This file is distributed under free software licence: 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 ...
MrTheodor/bakery
src/start_backmapping.py
Python
gpl-3.0
23,286
[ "Gaussian", "Gromacs" ]
4d52e678b725e22eb01cf8cf7ee570b8124e1e3d4aae90c46deb64d565347c3f
''' Functions for creating archives of all basis sets ''' import os import copy import zipfile import tarfile import io import datetime from . import api, writers, refconverters, misc from .writers.write import _writer_map _readme_str = '''Basis set exchange: Basis set bundle =========================================...
MOLSSI-BSE/basis_set_exchange
basis_set_exchange/bundle.py
Python
bsd-3-clause
6,812
[ "NWChem", "TURBOMOLE" ]
8870d6d8e5f46568991380aa1051dbc75bd66d24011255b977f2094c0b0943d4
# -*- coding: utf-8 -*- # # This file is part of Invenio. # Copyright (C) 2013, 2014, 2015 CERN. # # Invenio is free software; you can redistribute it and/or # modify it under the terms of the GNU General Public License as # published by the Free Software Foundation; either version 2 of the # License, or (at your optio...
zenodo/invenio
invenio/ext/script/__init__.py
Python
gpl-2.0
8,079
[ "VisIt" ]
78e1ab47e2fcd78df0bb3e86a3bf07348cc23e2aa62faae73e2e5149efcf3f4f
#!/usr/bin/env python3 import pyro from ..gp import GP from ._pyro_mixin import _PyroMixin class PyroGP(GP, _PyroMixin): """ A :obj:`~gpytorch.models.ApproximateGP` designed to work with Pyro. This module makes it possible to include GP models with more complex probablistic models, or to use likeli...
jrg365/gpytorch
gpytorch/models/pyro/pyro_gp.py
Python
mit
4,679
[ "Gaussian" ]
f3a64759410de942aa48752e84b1f28545445b8f7ac1a887e2b5f83ce11fa04a
# -*- coding: utf-8 -*- # Form implementation generated from reading ui file 'preferences.ui' # # Created by: PyQt5 UI code generator 5.10.1 # # WARNING! All changes made in this file will be lost! from PyQt5 import QtCore, QtGui, QtWidgets class Ui_Dialog(object): def setupUi(self, Dialog): Dialog.setOb...
alexisflesch/texamator
partielatormods/guis/guiprefs.py
Python
gpl-3.0
37,869
[ "VisIt" ]
b2ab673ea7c020a2e6827a92a74be2bc029a8ce8aed4fbab1e74b78e0a0d7799
#!/usr/bin/env python import sys, os import cnavgpost.mergehistories.event_cycles_module as histseg import pysam import cPickle as pickle import re def merge_segments_into_regions(event): if len(event.segs) ==0: event.make_segs_from_str() mylocs=[] for seg in event.segs: if seg.adj: mylocs.append((seg.c...
dzerbino/cn-avg
paper_figures/cnavgpost/genehistory/annotate_events.py
Python
bsd-3-clause
2,821
[ "pysam" ]
6338bd782a262b37c7a1f496a21cd14a427b7211803f264feffefa81706b4730
# -*- coding: utf-8 -*- from __future__ import unicode_literals from django.conf import settings from django.conf.urls import include, url from django.conf.urls.static import static from django.contrib import admin from django.views.generic import TemplateView urlpatterns = [ url(r'^$', TemplateView.as_view(tem...
willingc/succulent-pups
config/urls.py
Python
bsd-3-clause
1,303
[ "VisIt" ]
b9ea9aea0ca6655e1bbe74bfc04857663924733d4cc6a1f023fa545b9b7ed6e5
# # Copyright (c) 2017 Intel Corporation # # 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 t...
NervanaSystems/coach
rl_coach/exploration_policies/additive_noise.py
Python
apache-2.0
5,318
[ "Gaussian" ]
93347e03de32304997064027694386714a06957456e7925dba30b97db515a888
import numpy as np def gaussian(x, p): ''' gaussian(arr,p): p[0] = norm, p[1] = mean, p[2]=sigma ''' return p[0] * np.exp( -1 * (x - p[1])**2 / (2 * p[2]**2)) def double_gaussian(x, p): ''' gaussian(arr,p): p[0] = norm1, p[1] = mean1, p[2]=sigma1 p[3] = norm2, p[4] = mean2...
philrosenfield/TPAGB-calib
functions.py
Python
bsd-3-clause
777
[ "Gaussian" ]
89ddd5742b6ec8f58a6d6144bdf061959647c5f7476ff3c363c735b4d76ad05e
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 iso8601 import pymongo from pylons import c, g, request from ming import schema as S from ming impo...
leotrubach/sourceforge-allura
Allura/allura/model/auth.py
Python
apache-2.0
21,852
[ "VisIt" ]
2896d7051a6c9daf2ca17f92db32ac36a2b2530f48b02068975b5c07e7053448
# Copyright 2008-2015 Nokia Solutions and Networks # # 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 l...
fingeronthebutton/RIDE
src/robotide/lib/robot/result/merger.py
Python
apache-2.0
3,024
[ "VisIt" ]
9f44819afc34db34b9452c27a7e71442d8d1ef3bcd9ddf705c0c18139be5799c
# Copyright 2015 The TensorFlow Authors. All Rights Reserved. # # Licensed under the Apache License, Version 2.0 (the "License"); # you may not use this file except in compliance with the License. # You may obtain a copy of the License at # # http://www.apache.org/licenses/LICENSE-2.0 # # Unless required by applica...
Xeralux/tensorflow
tensorflow/python/ops/gradients_impl.py
Python
apache-2.0
41,167
[ "VisIt" ]
3a9445dc80dbf54fbb8a00161e43314c96350fdd5b6b0cd3a8572217cd2dd95e
# class generated by DeVIDE::createDeVIDEModuleFromVTKObject from module_kits.vtk_kit.mixins import SimpleVTKClassModuleBase import vtk class vtkImageMathematics(SimpleVTKClassModuleBase): def __init__(self, module_manager): SimpleVTKClassModuleBase.__init__( self, module_manager, v...
nagyistoce/devide
modules/vtk_basic/vtkImageMathematics.py
Python
bsd-3-clause
510
[ "VTK" ]
eead7f56d49c9ed29f167818fd7b462ece29cecbf24fdfa90b83a1b7c8af8679
#!/usr/bin/env python # -*- coding: utf-8 -*- # Copyright (c) 2014, 2015, 2016, 2018 Adam.Dybbroe # Author(s): # Adam.Dybbroe <adam.dybbroe@smhi.se> # Panu Lahtinen <panu.lahtinen@fmi.fi> # This program is free software: you can redistribute it and/or modify # it under the terms of the GNU General Public Licens...
pytroll/mpop
mpop/satin/nc_pps_l2.py
Python
gpl-3.0
41,291
[ "Bowtie", "NetCDF" ]
5ee5ca5160f5b8f16978779cac131015caa96300cbeae96c57c3a71b25d58cd1
""" Robust location and covariance estimators. Here are implemented estimators that are resistant to outliers. """ # Author: Virgile Fritsch <virgile.fritsch@inria.fr> # # License: BSD 3 clause import warnings import numbers import numpy as np from scipy import linalg from scipy.stats import chi2 from . import empir...
mbayon/TFG-MachineLearning
venv/lib/python3.6/site-packages/sklearn/covariance/robust_covariance.py
Python
mit
30,680
[ "Gaussian" ]
44d85e530a1307a431a2926ae4116ccf7f74aab6734be28ddd438c8cbd4ee67a
# proxy module from __future__ import absolute_import from mayavi.filters.decimatepro import *
enthought/etsproxy
enthought/mayavi/filters/decimatepro.py
Python
bsd-3-clause
95
[ "Mayavi" ]
4d2a02b48b641956f6eb45b03ac5a5985d066382d508e6f9e49ec4ce417b2214
# Copyright (c) Pymatgen Development Team. # Distributed under the terms of the MIT License. import json import os import unittest from monty.json import MontyDecoder from pymatgen.apps.battery.conversion_battery import ( ConversionElectrode, ConversionVoltagePair, ) from pymatgen.core.composition import Co...
materialsproject/pymatgen
pymatgen/apps/battery/tests/test_conversion_battery.py
Python
mit
3,687
[ "pymatgen" ]
4107e78895084b9ed8f1a1612aa1883ccccd92575aca67c7c069b041257a0cfc
''' Created on Oct 25, 2010 @author: joel ''' import pypyr.utils as pu import pypyr.mesh as pm import pypyr.physics.stokes as pps import pypyr.extra.poisson as pep import numpy as np import enthought.mayavi.mlab as emm import matplotlib.pyplot as mpl class MeshPlotter(pm.MeshBase): def __init__(self): pm...
joelphillips/pypyramid
src/scripts/stokesplot.py
Python
bsd-3-clause
3,545
[ "Mayavi" ]
50339e52a173168b9204029d39ddca569f481bbe3eeb22f628657de73ff1fb61
#!/usr/bin/env python """ DataSet """ """ Copyright 2001 Pearu Peterson all rights reserved, Pearu Peterson <pearu@ioc.ee> Permission to use, modify, and distribute this software is given under the terms of the LGPL. See http://www.fsf.org NO WARRANTY IS EXPRESSED OR IMPLIED. USE AT YOUR OWN RISK. $Revisi...
chunshen1987/iSS
utilities/for_paraview/lib/DataSet.py
Python
mit
3,486
[ "VTK" ]
842336ae465498edf091ccdb47952994a16b3da25c46ff984804b47089aa4fa6
"""Module to configure and run CP2K jobs. Index ----- .. currentmodule:: nanoqm.schedule.scheduleCP2K .. autosummary:: prepare_job_cp2k API --- .. autofunction:: prepare_job_cp2k """ import fnmatch import logging import os from os.path import join from pathlib import Path from typing import Any, Dict from nood...
SCM-NV/qmworks-namd
nanoqm/schedule/scheduleCP2K.py
Python
mit
3,247
[ "CP2K" ]
b17c5cd7e7a750aaffa886979cf7ef457bb1f2cc70cde228b8b3aa6b4039b821
import cv2 import numpy as np scale = 1 delta = 0 ddepth = cv2.CV_16S blur_scale = 3 img = cv2.imread('muscle_matrix.png') img = cv2.GaussianBlur(img,(blur_scale,blur_scale),0) img = cv2.imwrite('muscle_matrix.png') gray = cv2.cvtColor(img,cv2.COLOR_BGR2GRAY) # Gradient-X grad_x = cv2.Sobel(gray,ddepth,1,0,ksize...
SlideAtlas/SlideAtlas-Server
slideatlas/plugins/ipython/notebooks/image_orientations.py
Python
apache-2.0
966
[ "VisIt" ]
694a1c8ec905a4ef36e9fde3f280baffb7640a7d3eaeda5d9aee014fc1bc305d
"""User-friendly public interface to polynomial functions. """ from __future__ import print_function, division from sympy.core import ( S, Basic, Expr, I, Integer, Add, Mul, Dummy, Tuple ) from sympy.core.mul import _keep_coeff from sympy.core.symbol import Symbol from sympy.core.basic import preorder_traversal ...
MridulS/sympy
sympy/polys/polytools.py
Python
bsd-3-clause
171,947
[ "Gaussian" ]
ba8bef30bcb43d3cfdfb3f468d01f6e6bf98fa0416881889d7452ed86647f342
# -*- coding: utf-8 -*- """ Mdi sub window for displaying VTK render window. @author: Chris Scott """ from __future__ import print_function from __future__ import absolute_import from __future__ import unicode_literals from __future__ import division import logging import platform import ctypes from PySide2 import ...
chrisdjscott/Atoman
atoman/gui/rendererSubWindow.py
Python
mit
38,687
[ "VTK" ]
af7fd7c792b26e18088f5a297c668f71c42c493dc06debfc31efc22e420eea5c
# # Copyright (C) 2000 Stefan Seefeld # All rights reserved. # Licensed to the public under the terms of the GNU LGPL (>= 2), # see the file COPYING for details. # from Synopsis import IR, ASG from Synopsis.QualifiedName import QualifiedCxxName as QName from Synopsis.SourceFile import * import idlast, idltype, idlvisi...
stefanseefeld/synopsis
Synopsis/Parsers/IDL/omni.py
Python
lgpl-2.1
18,192
[ "VisIt" ]
7cae196893f8f5ab0cb28a1bc799c670365115b1e1c852200609755e3933d951
# -*- coding: utf-8 -*- ''' Copyright (c) 2015 by Tobias Houska This file is part of Statistical Parameter Estimation Tool (SPOTPY). :author: Tobias Houska Holds functions to analyse results out of the database. Note: This part of SPOTPY is in alpha status and not ready for production use. ''' import numpy as ...
gitporst/spotpy
spotpy/analyser.py
Python
mit
38,680
[ "Gaussian" ]
149934c96891195bad8d52758052a34e9681cb40bb0f284de9197307bc3f96b7
# Encoding utf-8 import sys import os import pymatgen as pmg import pymatgen.io.nwchem as nw from cage.core import Cage """ Script to set up the directories and input files to calculate the minimum energy paths for all non-equivalent facet combinations in a Cage molecule. """ # Cation parameters CATION = 'Na' STA...
mbercx/cage
cage/scripts/pathsetup.py
Python
mit
3,134
[ "NWChem", "pymatgen" ]
e34a55093ff34379f3b7e10a3cefcc201bc3650479c630e117968fa466e5b30a
#!/usr/bin/env python #---------------------------------------------------------------------- # Copyright (c) 2013-2015 Raytheon BBN Technologies # # Permission is hereby granted, free of charge, to any person obtaining # a copy of this software and/or hardware specification (the "Work") to # deal in the Work without ...
plantigrade/geni-tools
src/gcf/omnilib/stitch/objects.py
Python
mit
298,389
[ "ORCA" ]
caf2a0d14d09b8079c5cad13874943d8d90d82b9b199f5f7d2380cbef50249f2
# # Copyright (C) 2001 greg Landrum # from rdkit.ML.Data import Quantize from rdkit.Dbase import DbConnection from rdkit import RDConfig def runIt(namesAndTypes,dbConnect,nBounds,resCol,typesToDo=['float']): results = map(lambda x:x[0],dbConnect.GetColumns(namesAndTypes[resCol][0])) nPossibleRes = max(results)...
rdkit/rdkit-orig
rdkit/ML/Data/FindQuantBounds.py
Python
bsd-3-clause
1,670
[ "RDKit" ]
32307df7b653959129f07c4454415d3763685aa82506261d6d9d3dae3df7acb4
import unittest import numpy as np import pysal #from pysal.spreg.twosls import TSLS, BaseTSLS from scipy import sparse as SP from pysal.contrib.handler import Model from functools import partial TSLS = partial(Model, mtype='TSLS') class TestTSLS(unittest.TestCase): def setUp(self): db = pysal.open(pysal...
TaylorOshan/pysal
pysal/contrib/handler/tests/test_twosls_sparse.py
Python
bsd-3-clause
8,763
[ "COLUMBUS" ]
b09150983ab7c1407dc0fc1b388b1dbb25941e190dab464765b8139d82c516b7
import editdist import pandas as pd def observed_wellbc_extraction(line, AD1='GGAAGCCTTGGCTTTTG'): ''' This function returns the sequence (observed wellbc) before the first adaptor sequence ToDo, fix alignments to well bc Parameters ---------- line: Panda...
SuLab/RASLseqAligner
src/RASLseqWellbc.py
Python
mit
6,807
[ "BLAST" ]
05fdda0c7a1be904de8830facf4801a6a46acc84defe282cdf850106ccde7ceb