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# $Id$ # # Copyright (C) 2004-2008 Greg Landrum and Rational Discovery LLC # All Rights Reserved # """ Defines Naive Baysean classification model Based on development in: Chapter 6 of "Machine Learning" by Tom Mitchell """ import numpy from rdkit.ML.Data import Quantize def _getBinId(val, qBounds) : bid = ...
rdkit/rdkit-orig
rdkit/ML/NaiveBayes/ClassificationModel.py
Python
bsd-3-clause
8,744
[ "RDKit" ]
80a7d2f8272bc24e6fb86ee9c4ff9ed8c4cfd0c3f75004795dd1512e98ae11c3
from __future__ import division import numpy as np import copy import inspect import types as python_types import marshal import sys import warnings from keras import activations, initializations, regularizers, constraints from keras import backend as K from keras.engine import InputSpec, Layer from ke...
bnsnapper/keras_extensions
keras_extensions/rbm.py
Python
mit
21,081
[ "Gaussian" ]
d17273b8229d057e1b08f32e3b9dab00e48f600720c12d0f316de6c292dcab62
#!/usr/bin/python # coding=utf-8 __author__ = 'Didier Walliang' import math import numpy as np import matplotlib.pyplot as plt import os.path from matplotlib import dates from astropy.io import fits from astropy.modeling import models, fitting from astropy.convolution import Gaussian2DKernel from astropy.stats import ...
astrochoupe/seeing-measurement
measure.py
Python
gpl-2.0
14,551
[ "Gaussian" ]
92cca9e8a1d6e4c458de293050a0882e50f2c2d6000c835fc1bbfa04c48aabd3
# -*- coding: utf-8 *- # vi:si:et:sw=4:sts=4:ts=4 ## ## Copyright (C) 2005-2013 Async Open Source <http://www.async.com.br> ## All rights reserved ## ## This program is free software; you can redistribute it and/or modify ## it under the terms of the GNU General Public License as published by ## the Free Software Foun...
andrebellafronte/stoq
stoq/gui/shell/shell.py
Python
gpl-2.0
19,092
[ "VisIt" ]
6f78883062f843da37aecf11834dbc411b9411fd942c9af9644dee384b0b2479
""" Pijaz client application settings. Visit http://developer.pijaz.com/#manage-apps to create and edit client applications. """ # App ID. APP_ID = '' # API key. API_KEY = '' """ Product settings. Visit http://developer.pijaz.com/#theme-designer to create and edit platform products. """ # Workflow ID....
pijaz/pijaz-sdk
examples/python/config.sample.py
Python
mit
860
[ "VisIt" ]
4ce49c1d2ce838a157c21ea5169584bf519a8a2e3707e8503834d23ac4f0e37d
from sfepy.base.base import * from sfepy.solvers.solvers import NonlinearSolver import sfepy.base.plotutils as plu ## # 13.12.2005, c # 14.12.2005 # 02.10.2007 def check_tangent_matrix( conf, vec_x0, mtx_a0, evaluator ): vec_x = vec_x0.copy() delta = conf.delta vec_r, status = evaluator.eval_residual( vec...
certik/sfepy
sfepy/solvers/nls.py
Python
bsd-3-clause
9,028
[ "VTK" ]
6ed47d6d78b53d84ef1c8c9b2ae8bfac75a77bd09445369e214d59ae94531314
""" JobStateUpdateHandler is the implementation of the Job State updating service in the DISET framework The following methods are available in the Service interface setJobStatus() """ from __future__ import absolute_import import six from six.moves import range __RCSID__ = "$Id$" import time from DI...
fstagni/DIRAC
WorkloadManagementSystem/Service/JobStateUpdateHandler.py
Python
gpl-3.0
13,370
[ "DIRAC" ]
61b3bd66857cb601a7a8c6a677691638e2c9315a136bbacabfc2ca4bb48b425c
from distutils.version import StrictVersion import numpy as np import scipy import nose.tools as nt from unittest import mock from nose.plugins.skip import SkipTest import hyperspy.api as hs from hyperspy.misc.utils import slugify class TestModelJacobians: def setUp(self): s = hs.signals.Signal1D(np.ze...
vidartf/hyperspy
hyperspy/tests/model/test_model.py
Python
gpl-3.0
41,020
[ "Gaussian" ]
bd043695b02915ad46e48f95c308290b76549e42a62a088df11f9188e236b0cd
# Principal Component Analysis Code : from numpy import mean,cov,double,cumsum,dot,linalg,array,rank,size,flipud from pylab import * import numpy as np import matplotlib.pyplot as pp #from enthought.mayavi import mlab import scipy.ndimage as ni import roslib; roslib.load_manifest('sandbox_tapo_darpa_m3') import ro...
tapomayukh/projects_in_python
classification/Classification_with_kNN/Single_Contact_Classification/Feature_Comparison/multiple_features/results/test10_cross_validate_objects_1200ms_scaled_method_v_force_motion.py
Python
mit
4,600
[ "Mayavi" ]
a9c398d1595ca9a5e30ad94fd707717794b8368064154a63da5c08d696c644b8
# -*- coding: utf-8 -*- u"""SILAS execution template. :copyright: Copyright (c) 2020 RadiaSoft LLC. All Rights Reserved. :license: http://www.apache.org/licenses/LICENSE-2.0.html """ from __future__ import absolute_import, division, print_function from pykern import pkio from pykern import pkjson from pykern.pkcollec...
mkeilman/sirepo
sirepo/template/silas.py
Python
apache-2.0
11,600
[ "CRYSTAL" ]
f72f762ca571c8497c07321ff6fbeacbfaae36deed5482dacdff760e08d17cef
from distutils.core import setup from Cython.Build import cythonize from distutils.extension import Extension import numpy as np import mpi4py as mpi4py import sys import platform import subprocess as sp import os.path import string # Now get include paths from relevant python modules include_path = [mpi4py.get_inclu...
pressel/pycles
setup.py
Python
gpl-3.0
14,188
[ "NetCDF" ]
5ba63f45798cfe627dceaa4860a83f73edc167dd94713c91fdcfbb3a3b6f66bd
# This script reads the carrier database # and display it along a path in histogram form # along with a representation of the carriers in energy space from __future__ import print_function from __future__ import division from builtins import range from past.utils import old_div from yambopy import * import matplotlib....
henriquemiranda/yambo-py
scripts/realtime/plot_occ2.py
Python
bsd-3-clause
7,697
[ "DIRAC" ]
b67e3f6b1be8891b7b9f8e8fa70d303b240a2e69341affc813b3ede175ca6716
############################################################################## # Copyright (c) 2017-2018 Mark Olesen, OpenCFD Ltd. # # This file was authored by Mark Olesen <mark.olesen@esi-group.com> # and is released as part of spack under the LGPL license. # LLNL-CODE-647188 # # For details, see https://github.com/s...
matthiasdiener/spack
var/spack/repos/builtin/packages/openfoam-com/package.py
Python
lgpl-2.1
34,061
[ "ParaView", "VTK" ]
601a4c3f2eaa263d6a49efa80807c5a48af7edb3402abc3f54f862827a9afb27
# -*- coding: utf-8 -*- """Color constants and a getter function.""" def get(color_name): """Return specified color if exists, else return white.""" color = _COLORS.get(color_name) return color if color else 'white' # converting color name to color code here couldn't change the color # converting in ren...
kuraha4/roguelike-tutorial-python
src/colors.py
Python
mit
1,464
[ "Amber" ]
e0a8576a7dd8744caa48a2226a42b72dd4fbd04537eaa8001f92d7b3ddf490e9
""" ================= :mod:`crossovers` ================= .. Copyright 2012 Inspired Intelligence Initiative .. 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 Fou...
saulshanabrook/pushgp.py
thirdparty/inspyred-1.0/inspyred/ec/variators/crossovers.py
Python
bsd-3-clause
18,632
[ "Gaussian" ]
460e28e396410cde671e38d3c38bd283363b12d980c3b39036062a330a9eeaf1
## Copyright (c) 2015 Ryan Koesterer GNU General Public License v3 ## ## 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 l...
rmkoesterer/uga
uga/RunTools.py
Python
gpl-3.0
5,404
[ "pysam" ]
3f3eff5c39b8de1771ab3fa3cff6aee7a58b81fe3a7c97f0d48fbd82df5e9b7a
# -*- encoding: utf-8 -*- """ Gaussian optics. The module implements: - Ray transfer matrices for geometrical and gaussian optics. See RayTransferMatrix, GeometricRay and BeamParameter - Conjugation relations for geometrical and gaussian optics. See geometric_conj*, gauss_conj and conjugate_gauss_beams The co...
flacjacket/sympy
sympy/physics/gaussopt.py
Python
bsd-3-clause
19,362
[ "Gaussian" ]
e94939d7ae72d8d02d6b609d7029aa08557c2f35953b832b405a775c7caf1ffc
""" Module to set up run time parameters for Clawpack -- AMRClaw code. The values set in the function setrun are then written out to data files that will be read in by the Fortran code. """ import os import numpy as np t_shelf = 3.2*3600 # time approaching continental slope t_harbor = 3.5*3600 # time approachi...
clawpack/adjoint
paper1_examples/tsunami_Alaska/compare/setrun_sflag_lowtol.py
Python
bsd-2-clause
16,061
[ "NetCDF" ]
e2ebf51f70089a6c7017e00be3f7a99e9239f3b04b97342c3e971c1e0794c060
"""Utilities used in the Kadenze Academy Course on Deep Learning w/ Tensorflow. Creative Applications of Deep Learning w/ Tensorflow. Kadenze, Inc. Parag K. Mital Copyright Parag K. Mital, June 2016. """ import matplotlib.pyplot as plt import tensorflow as tf import urllib import numpy as np import zipfile import os ...
niazangels/CADL
session-5/libs/utils.py
Python
apache-2.0
21,027
[ "Gaussian" ]
e54985b4885462a6e89e117fc67d79afcb8309f20b87ab57ade4a1bd646955e0
import datetime import re import smtplib import time import urllib from typing import Any, List, Optional, Sequence from unittest.mock import MagicMock, patch import ujson from django.conf import settings from django.contrib.auth.views import INTERNAL_RESET_URL_TOKEN from django.contrib.contenttypes.models import Cont...
timabbott/zulip
zerver/tests/test_signup.py
Python
apache-2.0
198,704
[ "VisIt" ]
dad9f124078b596f77d2c2ab2f59581b3d488bec7e51c07ae8566d9f4976a8d7
import re from copy import deepcopy import numpy as np import tatsu from mdt.component_templates.base import ComponentBuilder, ComponentTemplate from mdt.lib.components import get_component from mdt.model_building.parameters import FreeParameter, ProtocolParameter from mdt.models.composite import DMRICompositeModel fr...
cbclab/MDT
mdt/component_templates/composite_models.py
Python
lgpl-3.0
21,871
[ "Gaussian" ]
513f0e7babcfaea9739fb6ecb7532476bbcec981a58fcd916a53cd22eae970f9
#!/usr/bin/env python import os import logging class DataFace(object): """ Some data IFace bowtie can work with. """ def size(self): raise NotImplementedError("size() needs to be implemented!") class SamFile(DataFace): def __init__(self,sam_desc): self.file_desc = sam_...
iml/bowtie2
scripts/test/dataface.py
Python
gpl-3.0
1,769
[ "Bowtie" ]
31ee5da6abe27dd437fded11357a9a3b1a19e0f9a84d31e008f2712b93256c69
#!/usr/bin/python # backpage_sitekey_to_marketid backpage_sitekey_to_marketid = { "abbotsford": "YXX", "aberdeen": "ABZ", "abilene": "ABI", "acapulco": "ACA", ...
usc-isi-i2/dig-alignment
versions/1.0/datasets/istr/market/sourcemarket.py
Python
apache-2.0
249,792
[ "COLUMBUS" ]
6d3567468c987f1369893fff957ad0294f28956b40e6d9cfdfd272c1a11aaa7a
import re from nxtools import * from .common import * def shorten(instr, nlen): line = instr.split("\n")[0] if len(line) < 100: return line return line[:nlen] + "..." def filter_match(f, r): """OR""" if type(f) in [list, tuple]: res = False for fl in f: if re.m...
immstudios/nebula-core
nebulacore/meta_utils.py
Python
gpl-3.0
1,789
[ "Firefly" ]
5a2aeecdac7ae3aba2a96ecbaf89f95ced9dcb283ff3fe568177f1285e6e1e85
#!/usr/bin/env python import time import math import numpy from appionlib import apDisplay from appionlib.apCtf import ctftools debug = False #=================== def generateCTF1d(radii=None, focus=1.0e-6, cs=2e-3, volts=120000, ampconst=0.07, failParams=False, overfocus=False): """ calculates a CTF function b...
vossman/ctfeval
appionlib/apCtf/genctf.py
Python
apache-2.0
9,912
[ "Gaussian" ]
4b916085627df98592713c7ac508b56d11b8d76334dd27513496955b863b5637
#!/usr/bin/python import httplib import httplib2 import os import random import sys import time from apiclient.discovery import build from apiclient.errors import HttpError from apiclient.http import MediaFileUpload from oauth2client.client import flow_from_clientsecrets from oauth2client.file import Storage from oau...
stu1992/Melbourne-Clouds
upload.py
Python
gpl-3.0
6,656
[ "VisIt" ]
a36404025f01c6920f0cc756422ddcc1066e5cbffad774cc6b23a61c3e49c189
# -*- coding: utf-8 -*- # creates: surface.png from ase.io import read, write exec(compile(open('N2Cu.py').read(), 'N2Cu.py', 'exec')) image = read('N2Cu.traj@-1') write('surface.pov', image, transparent=False, display=False, run_povray=True)
misdoro/python-ase
doc/tutorials/surface.py
Python
gpl-2.0
243
[ "ASE" ]
97fa8f1bd83ec08d8a39bb4aa101d026f118cb054127e3951b8d2502863df81c
# $Id$ # # Copyright (C) 2003-2006 greg Landrum and Rational Discovery LLC # # @@ All Rights Reserved @@ # This file is part of the RDKit. # The contents are covered by the terms of the BSD license # which is included in the file license.txt, found at the root # of the RDKit source tree. # from __future__ impor...
strets123/rdkit
rdkit/Dbase/DbInfo.py
Python
bsd-3-clause
5,347
[ "RDKit" ]
cb2d1ce09305456af88f274c86e0c46dec552fdb918817b6a2485a47b245df05
""" Views for user API """ from django.shortcuts import redirect from django.utils import dateparse from rest_framework import generics, views from rest_framework.decorators import api_view from rest_framework.response import Response from opaque_keys.edx.keys import UsageKey from opaque_keys import InvalidKeyError ...
vismartltd/edx-platform
lms/djangoapps/mobile_api/users/views.py
Python
agpl-3.0
9,321
[ "VisIt" ]
4d82c2e36d913be394c1ca3c9c75e72220b115b8f7e1051c1685faab4176d586
# # 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/test/zoo/orca/automl/test_metrics.py
Python
apache-2.0
8,596
[ "ORCA" ]
62014fbb78143cf55e729bb05115fa502dfcf3ddf97c35d1ceb03ea79ff0ed19
#!/usr/bin/env python # -*- coding: utf-8 -*- # Copyright (C) 2009-2014: # Gabes Jean, naparuba@gmail.com # Gerhard Lausser, Gerhard.Lausser@consol.de # Gregory Starck, g.starck@gmail.com # Hartmut Goebel, h.goebel@goebel-consult.de # # This file is part of Shinken. # # Shinken is free software: you c...
kaji-project/shinken
shinken/stats.py
Python
agpl-3.0
6,828
[ "CRYSTAL" ]
44946b6544d084fd514b1582dfcdd1dc6a989bd853a43ecd92e42a10d7f79305
import LFPy import numpy as np import matplotlib.pylab as pl import sys import os import random as random #setting a random seed to get the same result all the time np.random.seed(1988) #what this program need fro running #where is and will be the data f2 = open('cellname', 'r') celln = [line.strip() for line in f2] c...
csdori/skCSD
simulation/LFP_calc_sine.py
Python
bsd-3-clause
8,494
[ "NEURON" ]
783422a9033b7d86f08649752917bc22e34b396826c7461561c9493fe3fbd626
# Name: mapper_metno_hfr # Purpose: Mapper for CODAR SeaSonde High-Frequency radar data provided by MET Norway # For data see: https://thredds.met.no/thredds/catalog/remotesensinghfradar/catalog.html # Authors: Artem Moiseev # Licence: This file is part of NANSAT. You can redistribute it...
nansencenter/nansat
nansat/mappers/mapper_metno_hfr.py
Python
gpl-3.0
6,968
[ "NetCDF" ]
a08bf80b8aab9b70eecbc05e74b89b9f962ca468ea00934329b80993e647baba
from typing import List import pytest from find import search from find.search import InvalidValueException from magic import seasons from magic.database import db # Some of these tests only work hooked up to a cards db, and are thus marked functional. They are fast, though, and you should run them if editing card s...
PennyDreadfulMTG/Penny-Dreadful-Tools
find/find_test.py
Python
gpl-3.0
23,978
[ "Amber", "BLAST" ]
66df5a92a5a3951c75dce557c2865aac3896b02062b3caf2923b6910877248e5
# Include the Dropbox SDK libraries from dropbox import session # Onitu has a unique set of App key and secret to identify it. ONITU_APP_KEY = "6towoytqygvexx3" ONITU_APP_SECRET = "90hsd4z4d8eu3pp" # ACCESS_TYPE should be 'dropbox' or 'app_folder' as configured for your app ACCESS_TYPE = 'dropbox' sess = session.Dro...
onitu/onitu
drivers/dropbox/get_access_token.py
Python
mit
1,017
[ "VisIt" ]
aa189e37eec31ce5b968c9e970c577f8a1e7327be531ca6fc707deab0aedd629
#!/usr/bin/env python # Copyright 2014-2018 The PySCF Developers. All Rights Reserved. # # Licensed under the Apache License, Version 2.0 (the "License"); # you may not use this file except in compliance with the License. # You may obtain a copy of the License at # # http://www.apache.org/licenses/LICENSE-2.0 # # U...
gkc1000/pyscf
pyscf/cc/gccsd_t_slow.py
Python
apache-2.0
2,817
[ "PySCF" ]
f903317330d7725a1274d371ff6f31df0000054635263b6a0f602379475cc8cd
NAME = "Minbias1PV" #from tempfile import mkstemp #from shutil import move #from os import remove, close # #def replace(file_path, pattern, subst): # #Create temp file # fh, abs_path = mkstemp() # with open(abs_path,'w') as new_file: # with open(file_path) as old_file: # for line in old_file...
saschastahl/ridge-analysis
scripts/GangaData2015.py
Python
mit
1,323
[ "DIRAC" ]
bc0bcd7083081e765293605e6429f8ce26f6d508ffa30cd1c8ac646d84b446de
#!/usr/bin/env python3 #* This file is part of the MOOSE framework #* https://www.mooseframework.org #* #* All rights reserved, see COPYRIGHT for full restrictions #* https://github.com/idaholab/moose/blob/master/COPYRIGHT #* #* Licensed under LGPL 2.1, please see LICENSE for details #* https://www.gnu.org/licenses/lgp...
nuclear-wizard/moose
modules/tensor_mechanics/test/tests/capped_mohr_coulomb/small_deform_hard_22.py
Python
lgpl-2.1
1,644
[ "MOOSE" ]
689eee2e7e0a5cf95f154e1d557a39187b0a8ce2eef264bba8f6f933e16dced3
#!/usr/bin/env python3 #* This file is part of the MOOSE framework #* https://www.mooseframework.org #* #* All rights reserved, see COPYRIGHT for full restrictions #* https://github.com/idaholab/moose/blob/master/COPYRIGHT #* #* Licensed under LGPL 2.1, please see LICENSE for details #* https://www.gnu.org/licenses/lgp...
nuclear-wizard/moose
python/mooseutils/sqa_check.py
Python
lgpl-2.1
4,229
[ "MOOSE" ]
837c5326bc91b46cbd72f421e6ea4520ffd052c37344cecb9f30b0f48075bda2
# 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 ...
juanchopanza/NeuroM
neurom/core/_neuron.py
Python
bsd-3-clause
9,124
[ "NEURON" ]
cc6a0399aab3b4ceb23d79bb169224317b28c3505148b96d3e7088cf10e166ef
""" The B{0install select} command-line interface. """ # Copyright (C) 2011, Thomas Leonard # See the README file for details, or visit http://0install.net. import os, sys import logging from zeroinstall import _ from zeroinstall.cmd import UsageError from zeroinstall.injector import model, selections, requirements ...
pombredanne/zero-install
zeroinstall/cmd/select.py
Python
lgpl-2.1
6,751
[ "VisIt" ]
6979fb741acaeef3fb2d4f86c0a1a22571733e7462e107e430bb43bdc4e5f77e
'''Module with classes and methods to analyse and process exported geomodel grids Created on 21/03/2014 @author: Florian Wellmann (some parts originally developed by Erik Schaeffer) ''' import numpy as np try: import matplotlib.pyplot as plt except ImportError: print("\n\n\tMatplotlib not installed - plotting...
flohorovicic/pygeomod
pygeomod/geogrid.py
Python
mit
38,875
[ "VTK" ]
dee58c68c7d6c6f6db378df693eda6bf33203b195158641ec88a897376a140d7
#!/usr/bin/python """ This script is an HTSeq alternatives. It is count reads in regions, but if there are overlapping regions the read is counted in both regions. Read also counted if partially overlap """ import sys import gzip class Exon: def __init__(self, fields): self.chrx = fields[0] self....
TravisCG/SI_scripts
exonreadcount.py
Python
gpl-3.0
1,804
[ "HTSeq" ]
a9f9480574f70bdfc9902b7cd6517135c9663f9d260982c1722af4ced83ad0e9
from django.conf.urls import url from . import views urlpatterns = [ url(r'^(?P<domain>.{1,36})/downlad.js/?$', views.downloadJS, name='downloadJS'), url(r'^(?P<domain>.{1,36})/visit.js/?$', views.trackerJS, name='trackerJS'), url(r'^(?P<domain>.{1,36})/visit.js/(?P<visitor>.{1,36})/?$', views.track...
hicinformatic/DJANGO-Tracker
urls.py
Python
gpl-3.0
2,604
[ "VisIt" ]
1f7f0c215d5671fee10e8e5d4895c16b48b1a10b05b4e1708794fbd43745ed5f
""" This tests only need the JobDB, and connects directly to it Suggestion: for local testing, run this with:: python -m pytest -c ../pytest.ini -vv tests/Integration/WorkloadManagementSystem/Test_JobDB.py """ # pylint: disable=wrong-import-position from DIRAC.Core.Base.Script import parseCommandLine pa...
petricm/DIRAC
tests/Integration/WorkloadManagementSystem/Test_JobDB.py
Python
gpl-3.0
2,640
[ "DIRAC" ]
a2b19376ccb2877b6f1f0b50ca8998c99be0da8450bcc2c73fd4154c1a018366
# Principal Component Analysis Code : from numpy import mean,cov,double,cumsum,dot,linalg,array,rank,size,flipud from pylab import * import numpy as np import matplotlib.pyplot as pp #from enthought.mayavi import mlab import scipy.ndimage as ni import roslib; roslib.load_manifest('sandbox_tapo_darpa_m3') import ro...
tapomayukh/projects_in_python
sandbox_tapo/src/skin_related/BMED_8813_HAP/Features/multiple_features/best_kNN_PC/cross_validate_categories_kNN_PC_BMED_8813_HAP_scaled_method_II_area_force.py
Python
mit
4,444
[ "Mayavi" ]
9392fb83504fac97e6d320223066d699570659222da5d174f53bc1249b0d5cc7
# Module wordnet.py # # Original author: Oliver Steele <steele@osteele.com> # Project Page: http://sourceforge.net/projects/pywordnet # # Copyright (c) 1998-2004 by Oliver Steele. Use is permitted under # the Artistic License # <http://www.opensource.org/licenses/artistic-license.html> """Utility functions to use wit...
PennNLP/SLURP
semantics/wntools.py
Python
gpl-3.0
12,392
[ "Amber" ]
f8534cdff38ef2721093e07f4e5e63e92773dde8252b28c3acd32894975b27b5
def get_versions(): return versions[0]["number"] versions = [ { "number": "1.7.5.3", "features": [ "1. get_organelle_from_reads.py: fix a bug when no qualified reads found (issue 123)", "2. get_organelle_from_reads.py: pass --spades-options to pre-assembly for Mac M1 ...
Kinggerm/GetOrganelle
GetOrganelleLib/versions.py
Python
gpl-3.0
31,892
[ "BLAST" ]
93f859fb4d5191267d79c9baec1852b5ab55c681829c791244a104daf8f8dc3b
#!/usr/bin/python3 import numpy as np # For array operations. import sys nx = 0 # number of points in Ox; if 0, then search dns.ini ny = 0 # number of points in Oy; if 0, then search dns.ini nz = 0 # number of points in Oz; if 0, then search dns.ini sizeofmask = 6 # do not edit below this line # getting grid siz...
zrick/tlab
scripts/python/xdmf.py
Python
gpl-3.0
9,712
[ "ParaView" ]
0a8a91d2b5f11be4e296a10dd041cbec3e2d6c0fa365b736c22086c6129d9818
# class generated by DeVIDE::createDeVIDEModuleFromVTKObject from module_kits.vtk_kit.mixins import SimpleVTKClassModuleBase import vtk class vtkStreamPoints(SimpleVTKClassModuleBase): def __init__(self, module_manager): SimpleVTKClassModuleBase.__init__( self, module_manager, vtk.v...
nagyistoce/devide
modules/vtk_basic/vtkStreamPoints.py
Python
bsd-3-clause
497
[ "VTK" ]
795e630317ede4a8f8259c245d546e6a68c9687a7da880fec83846ae27ec0ae8
# # Gramps - a GTK+/GNOME based genealogy program # # Copyright (C) 2002-2007 Donald N. Allingham # Copyright (C) 2007-2008 Brian G. Matherly # Copyright (C) 2011 Tim G L Lyons # # This program is free software; you can redistribute it and/or modify # it under the terms of the GNU General Public License as publ...
beernarrd/gramps
gramps/gen/filters/rules/family/__init__.py
Python
gpl-2.0
2,993
[ "Brian" ]
f9c8cb1af93c6b8cdf4399af5389be62a5bc2385dbab7ec961eccb0b813e1aaf
import param import topo.pattern import topo.pattern.random import __main__ import os import contrib import topo from topo.transferfn.misc import PatternCombine from topo.transferfn.misc import HalfRectify from topo import numbergen from topo.pattern import Gaussian from topo.numbergen import UniformRandom, BoundedNum...
ioam/svn-history
contrib/JanA/surround_model_design.py
Python
bsd-3-clause
33,000
[ "Gaussian" ]
f7dcc8699ef1f02cd1aad40988dc5d8a630f42433ded329c046aee3d5311885f
# -*- 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 publi...
thica/ORCA-Remote
src/ORCA/utils/Platform/generic/generic_RegisterSoundProvider.py
Python
gpl-3.0
966
[ "ORCA" ]
029286931b27d409f8875b9ee7d7c9b479db0dfff20872872e4218d62e15b789
from __future__ import generators from pygr.leelabdb import * import pygr.coordinator def map_clusters(server,**kwargs): "map clusters one by one" hg17=BlastDB(ifile=server.open_resource('hg17','r')) # CONSTRUCT RESOURCE FOR US IF NEEDED # LOAD DB SCHEMA (clusters,exons,splices,genomic_seq,spliceGraph...
ctb/pygr
tests/oldtests/old/mapclusters3.py
Python
bsd-3-clause
1,250
[ "BLAST" ]
251b13365140b653ba5d06bec421580aa333a9cd92f53f43af45cb5b07f72035
#!/usr/bin/python """Test of navigation to same page links.""" from macaroon.playback import * import utils sequence = MacroSequence() #sequence.append(WaitForDocLoad()) sequence.append(PauseAction(5000)) sequence.append(utils.StartRecordingAction()) sequence.append(KeyComboAction("<Control>Home")) sequence.append...
GNOME/orca
test/keystrokes/firefox/line_nav_follow_same_page_link.py
Python
lgpl-2.1
2,088
[ "ORCA" ]
0e85631c96f15745f8d7028709b8f0b01b678337e9ae9ee271cad70a4f43cc00
# -*- coding: utf-8 -*- import os from click import Argument from groundwork.patterns import GwCommandsPattern, GwRecipesPattern class GwRecipesBuilder(GwCommandsPattern, GwRecipesPattern): """ Provides commands for listing and building recipes via command line interface. Provided commands: * reci...
useblocks/groundwork
groundwork/plugins/gw_recipes_builder.py
Python
mit
3,282
[ "VisIt" ]
0047221d0bf48bad3cd49ef99d64a54109372613b98c8982c84b25ff1ac6b0a7
""" Unit tests for basic CDL constructs. """ import os import tempfile import unittest import cdlparser import numpy as np #--------------------------------------------------------------------------------------------------- class TestBasics(unittest.TestCase) : #--------------------------------------------------------...
ocehugo/cdlparser
test/test_basics.py
Python
bsd-3-clause
2,901
[ "NetCDF" ]
16cc26fae77b858742665a1bf535e9b6314309c4b0dd4d98f72c132839824d8e
import numpy as np from ase.units import Bohr """This module defines different external potentials to be used in time-independent and time-dependent calculations.""" class ExternalPotential: """ External potential """ def __init__(self, vext_g=None, gd=None): """Initialize with a grid and the c...
qsnake/gpaw
gpaw/external_potential.py
Python
gpl-3.0
13,131
[ "ASE" ]
f887b35263eb4b4cb5f00887f242bb18067c40b9004955c3c70b5220d03a871e
from sqlalchemy.types import * import json import pickle import copy import uuid import binascii from galaxy.util.bunch import Bunch from galaxy.util.aliaspickler import AliasPickleModule # For monkeypatching BIGINT import sqlalchemy.dialects.sqlite import sqlalchemy.dialects.postgresql import sqlalchemy.dialects.mys...
mikel-egana-aranguren/SADI-Galaxy-Docker
galaxy-dist/lib/galaxy/model/custom_types.py
Python
gpl-3.0
4,279
[ "Galaxy" ]
4977ce6b363d3f14b6b3be7186cfafbc828be19c64b0adedb1936e4dea3e62dd
"""Pylons middleware initialization""" import types from beaker.middleware import CacheMiddleware, SessionMiddleware from routes.middleware import RoutesMiddleware from paste.cascade import Cascade from paste.registry import RegistryManager from paste.urlparser import StaticURLParser from paste.deploy.converters impo...
DIRACGrid/DIRACWeb
dirac/config/middleware.py
Python
gpl-3.0
2,564
[ "DIRAC" ]
2ea85ba099bc7803d0a3ac4a7f90bb4b3be5ec3dfc30cb92b464058f512e5542
#!/usr/bin/python # # @author: Gaurav Rastogi (grastogi@avinetworks.com) # Eric Anderson (eanderson@avinetworks.com) # module_check: supported # Avi Version: 17.1.1 # # Copyright: (c) 2017 Gaurav Rastogi, <grastogi@avinetworks.com> # GNU General Public License v3.0+ (see COPYING or https://www.gnu.org/licenses...
alexlo03/ansible
lib/ansible/modules/network/avi/avi_cloudconnectoruser.py
Python
gpl-3.0
4,187
[ "VisIt" ]
7011fb21fd659ebf76eb8773fa4688a9e1d796e2e594d3aede2226716513f72d
"""A Chaco file reader. """ # Author: Suyog Dutt Jain <suyog.jain@aero.iitb.ac.in> # Copyright (c) 2009, Enthought, Inc. # License: BSD Style. # Enthought library imports. from traits.api import Instance, Str from traitsui.api import View, Group, Item from tvtk.api import tvtk # Local imports. from mayavi.core.source...
dmsurti/mayavi
mayavi/sources/chaco_reader.py
Python
bsd-3-clause
2,647
[ "Mayavi", "VTK" ]
55b6088d116a6eeae75101c2156221760942f4fda3a27333cb1d2d8e068e96f8
from __future__ import nested_scopes """ ################################################################################ # # SOAPpy - Cayce Ullman (cayce@actzero.com) # Brian Matthews (blm@actzero.com) # Gregory Warnes (Gregory.R.Warnes@Pfizer.com) # Christopher Blunck (blunck...
nzsquirrell/p2pool-myriad
oldstuff/SOAPpy/NS.py
Python
gpl-3.0
3,724
[ "Brian" ]
7187143df3653840e54c01ca340fee44ebd029814e1bdbd3b69317a710bbcdc1
# # Copyright (C) 2013,2014 The ESPResSo project # # This file is part of ESPResSo. # # ESPResSo is free software: you can redistribute it and/or modify # it under the terms of the GNU General Public License as published by # the Free Software Foundation, either version 3 of the License, or # (at your option) any later...
sehrhardt/espresso
testsuite/python/nonBondedInteractions.py
Python
gpl-3.0
5,205
[ "ESPResSo" ]
6f8f1b95a9d9423902777dd5704601f4cf7fc023bb314c49e1f299a29f1e2d45
#Chip.py #Implements a casino chip, which is used for betting on games. #Created by: Andrew Davis #Created on: 1/9/2016 #Open source (MIT license) #import statements from Utilities import get_chip_color #class declaration for Chip superclass class Chip(object): """A Chip is a representation of money in fixed ...
techgineer/casino-sim
src/Chip.py
Python
mit
2,552
[ "CASINO" ]
d60f11f990653d8277c9ca89f2ce32e34a92857cfa35e8e931e679f038c464ca
#! /bin/env python # Python Distutils setup script for SPARX # VERSION_NUMBER of SPARX VERSION_NUMBER = '3.1.3' # number of Thread using in per job ENABLE_MULTITREADING = 1 if ENABLE_MULTITREADING: import multiprocessing NumberOfThread = 2 * multiprocessing.cpu_count() else: NumberOfThread = ...
itahsieh/sparx-alpha
setup.py
Python
gpl-3.0
7,096
[ "VTK" ]
4d6ba870b8e3f1a578169782604ffbb405cd91c7a5e4ac0d9bf52c8cd438db96
# Copyright (C) 2016 # Max Planck Institute for Polymer Research & JGU Mainz # 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 ...
espressopp/espressopp
src/io/DumpXYZ.py
Python
gpl-3.0
4,709
[ "ESPResSo" ]
91b669149e0084691c70a29c6d1072afa40cdbdc607c4fc7f4440a88ef92ac18
# -*- coding: utf-8 -*- import os, json import flannelfox.tools from collections import OrderedDict if os.environ.get('FF_ROOT', False): HOME_DIR = os.environ.get('FF_ROOT') else: HOME_DIR = os.path.expanduser('~') # ############################################################################# # Special variables t...
FlannelFox/FlannelFox
flannelfox/settings.py
Python
mit
5,166
[ "Galaxy" ]
35c49bc9c2452851ffb615eec50b81e0af72516212f56acb88fa8353fa50c545
"""Get dependencies from packages on the Python Package Index (PyPI) Adapted from Olivier Girardot's notebook: https://github.com/ogirardot/meta-deps/blob/master/PyPi%20Metadata.ipynb licensed under the Creative Commons Attribution 3.0 Unported License. To view a copy of that license, visit http://creativecommons.o...
hdashnow/python-dependencies
dependencies.py
Python
mit
5,312
[ "VisIt" ]
c7170bef28fb2ecf9effe57226ce83138f9cf1e3df6d7af68dbcd66bdea16ef5
# -*- coding: utf-8 -*- # Copyright(C) 2008-2011 Romain Bignon # # This file is part of a weboob module. # # This weboob module 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 ...
laurentb/weboob
modules/aum/contact.py
Python
lgpl-3.0
11,860
[ "exciting" ]
cad69e175186897a6eed8fe3522325de7ffbd6774bc0766740f1b28672cb0d2b
#!/usr/bin/python # -*- coding: utf-8 -*- # # Copyright 2010 British Broadcasting Corporation and Kamaelia Contributors(1) # # (1) Kamaelia Contributors are listed in the AUTHORS file and at # http://www.kamaelia.org/AUTHORS - please extend this file, # not this notice. # # Licensed under the Apache License, V...
sparkslabs/kamaelia
Sketches/MPS/VideoRecorder/VideoRecord.py
Python
apache-2.0
3,283
[ "DIRAC" ]
3d0a03726f8d421049b2f6e982f8ac520ef130a965c36c7f9ee9f5444bfb7cd8
# -*- coding: utf-8 -*- # # brunel_delta_nest.py # # This file is part of NEST. # # Copyright (C) 2004 The NEST Initiative # # NEST is free software: you can redistribute it and/or modify # it under the terms of the GNU General Public License as published by # the Free Software Foundation, either version 2 of the Licen...
espenhgn/nest-simulator
pynest/examples/brunel_delta_nest.py
Python
gpl-2.0
12,068
[ "NEURON" ]
4ce930317ac307bce4fb23f8d4f52bc34c9052f5fc1f3b20c95121ac26caa8e3
from Firefly import logging from Firefly.components.zwave.device_types.switch import ZwaveSwitch from Firefly.const import ACTION_OFF, ACTION_ON, SWITCH from Firefly.services.alexa.alexa_const import ALEXA_SMARTPLUG TITLE = 'Aeotec Smart Switch 6' BATTERY = 'battery' ALARM = 'alarm' POWER_METER = 'power_meter' VOLTAG...
Firefly-Automation/Firefly
Firefly/components/zwave/aeotec/zw096_smart_switch_6.py
Python
apache-2.0
2,215
[ "Firefly" ]
404335b3b164d45c3aba92924918eabc328971cc2c586dfb3ed766854dc8914d
import sys if sys.version_info < (3,0): from urllib import urlopen fileHeader = "/user/schafer/web/outreach/dojo/" else: from urllib.request import urlopen fileHeader = "../" exclusionList = ["CVCoderDojo","jbschafer","uniscratch"] approvalList = ["CVCoderDojo","jbschafer","uniscratch","crogersaea267"]...
jbschafer/LearningLabServer
scripts/updateProgress.py
Python
gpl-2.0
14,443
[ "VisIt" ]
932fac06616a82b2bd744f7a214870e0c214f46860600d12dd504d7745715a3c
#!/usr/bin/env python # L. Brodeau, 2015 # Potential temperature to conservative temperature (TEOS 10) import sys import os import numpy as nmp from netCDF4 import Dataset from string import replace import gsw if len(sys.argv) != 5: print 'Usage: '+sys.argv[0]+' <Temperature_file_to_convert> <temperature_nam...
brodeau/barakuda
python/exec/convert_pt_to_CT.py
Python
gpl-2.0
2,140
[ "NetCDF" ]
ccac1e465c24bc090c0d62cc97691b01d7e9ead8da2761d3bb3d85ee7b7d620b
class Module: def __init__(self, mainMenu, params=[]): # metadata info about the module, not modified during runtime self.info = { # name for the module that will appear in module menus 'Name': 'Linux PillageUser', # list of one or more authors for the module ...
EmpireProject/EmPyre
lib/modules/collection/linux/pillage_user.py
Python
bsd-3-clause
4,805
[ "BLAST" ]
2a8f6a7780a625f58bceef04d1bd8ce68828c44ca559e99ed08eaed8577b8c4f
import base64 import traceback import pyglet from geoplotlib.core import GeoplotlibApp from core import FONT_NAME class AppConfig: def __init__(self): self.reset() def reset(self): self.layers = [] self.bbox = None self.savefig = None self.tiles_provider = 'positron'...
andrea-cuttone/geoplotlib
geoplotlib/__init__.py
Python
mit
12,232
[ "Gaussian" ]
f1b40f2f66b22c3e06cc57bb82a9a8371a57ea39215ff22920c6d71d9a8fab95
import unittest from uptide.netcdf_reader import NetCDFInterpolator, CoordinateError, NetCDFFile import itertools import os from numpy import arange, array, ones # function used to fill the netcdf field, has to be linear def f(lat, lon): return lat*10 + lon test_file_name1 = 'tests/test_netcdf_reader1.nc' test_...
stephankramer/uptide
tests/test_netcdf_reader.py
Python
lgpl-3.0
6,525
[ "NetCDF" ]
847418e65ffe0805c3ff5fca756b67664f450fdd2b7318183b33c0bcb64a26dc
# Copyright (c) 2015-2016, 2018 Claudiu Popa <pcmanticore@gmail.com> # Copyright (c) 2016 Ceridwen <ceridwenv@gmail.com> # Copyright (c) 2018 Nick Drozd <nicholasdrozd@gmail.com> # Licensed under the LGPL: https://www.gnu.org/licenses/old-licenses/lgpl-2.1.en.html # For details: https://github.com/PyCQA/astroid/blob/m...
ekwoodrich/python-dvrip
env/lib/python3.5/site-packages/astroid/transforms.py
Python
mit
3,377
[ "VisIt" ]
d67a70256710512223729716775a5cf9d261b473b289ba101ec11300841de5ca
""" Functions to visualize an Experiment. """ __authors__ = "James Bergstra" __license__ = "3-clause BSD License" __contact__ = "James Bergstra <pylearn-dev@googlegroups.com>" import math import sys # -- don't import this here because it locks in the backend # and we want the unittests to be able to set th...
CVML/hyperopt
hyperopt/plotting.py
Python
bsd-3-clause
19,940
[ "Gaussian" ]
be6b7e65009b3a022833e7c43f664ead2d567d6074aa355e411da774930df3dc
import numpy as np from ase.units import Bohr from gpaw import Calculator from gpaw.localized_functions import create_localized_functions as clf class STM: def __init__(self, surfacecalc, tipcalc): self.scalc = surfacecalc self.tcalc = tipcalc self.surface = surfacecalc.get_atoms() ...
qsnake/gpaw
gpaw/stm/__init__.py
Python
gpl-3.0
1,977
[ "ASE", "GPAW" ]
3dd55e08a88cf4207b1fd6cec3a6f8fe33679330d5c7b8af13239b1efc09d26e
import numpy as np import argparse from time import time from builder.args import addLoggingParams, addDebuggingParams, \ addEarlyStop, addSupDataParams from builder.profiler import setupLogging from ae.net import TrainerSAENetwork from ae.contiguousAE import ContiguousAutoEncoder from ae.con...
mbojrab/playbox
trunk/projects/supervised/semiSupervisedTrainer.py
Python
mit
6,842
[ "NEURON" ]
aadfb04c709208d87300ffb9a39e027bdf6b453596bfe6491b1d75971e1b66ad
# -*- 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...
upibhalla/moose-core
python/moose/neuroml/MorphML.py
Python
gpl-3.0
40,773
[ "MOOSE", "NEURON" ]
11fa136505fe0c251b2c49924a7383cf067e3769e39aa184adf0be21a7dec604
# coding=utf-8 # Copyright 2022 The Google Research 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 applicab...
google-research/google-research
mol_dqn/chemgraph/dqn/run_dqn.py
Python
apache-2.0
15,386
[ "RDKit" ]
e96467655a139cfeb2f320fe14095f7e40d48673a46bd402141d19bd9fa45c23
#!/usr/bin/env python # -*- coding: utf-8 -*- """Defines classes and methods used for recurrent neuronal networks. Copyright (C) 2012 Computational Neuroscience Group, NMBU. 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 Fr...
espenhgn/LFPy
LFPy/network.py
Python
gpl-3.0
66,722
[ "NEURON" ]
251efcb3f8b938cce3430c9c326bca016f337ccd897964a62e43d0c3ad39cb78
import sys import json import random import numpy as np def sigmoid(z): """ Return the sigmoid function evaluated at the given input. :param z: Vector or scalar input. :return: Sigmoid of the given input. """ return 1.0 / (1.0 + np.exp(-z)) def sigmoid_prime(z): """ ...
mrbell/connectfour
tdc4bot.py
Python
gpl-3.0
6,309
[ "Gaussian" ]
1ae0dbf119c1890f5cc19ea0a1802873f824159f84555ae491d2aea1cbea607c
"""Probit regression class and diagnostics.""" __author__ = "Luc Anselin luc.anselin@asu.edu, Pedro V. Amaral pedro.amaral@asu.edu" import numpy as np import numpy.linalg as la import scipy.optimize as op from scipy.stats import norm, chisqprob import scipy.sparse as SP import user_output as USER import sum...
spreg-git/pysal
pysal/spreg/probit.py
Python
bsd-3-clause
26,765
[ "COLUMBUS" ]
84bb201c23f9372d91133546df1791aac7722b66dd6fb7034efcad505c07cb5d
# The MIT License (MIT) # # Copyright (c) 2018, TU Wien # # 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,...
wpreimes/gldas
src/gldas/interface.py
Python
bsd-3-clause
16,937
[ "NetCDF" ]
19c6e282d87ce9b6cdd59b621f42196e8b3761e7b8bee98ae6dfa7049770316e
#!/usr/bin/env python -i # preceding line should have path for Python on your machine # demo.py # Purpose: illustrate use of many library interface commands # Syntax: demo.py # uses in.demo as LAMMPS input script from __future__ import print_function import sys # parse command line argv = sys.argv if len(...
Pakketeretet2/lammps
python/examples/demo.py
Python
gpl-2.0
1,302
[ "LAMMPS" ]
feffb91a1dccc757f712af376a4bfe7aacded9e2fcbab355ab24f64c1a0f97b5
"""A simple wrapper for `tvtk.Cutter`. """ # Author: Prabhu Ramachandran <prabhu_r@users.sf.net> # Copyright (c) 2005-2008, Enthought, Inc. # License: BSD Style. # Enthought library imports. from traits.api import Instance, Property from traitsui.api import View, Group, Item from tvtk.api import tvtk # Local imports...
dmsurti/mayavi
mayavi/components/cutter.py
Python
bsd-3-clause
2,478
[ "Mayavi" ]
bfd4bdecd4445d0a5e03e69aed198b155d4953efa89258d96d74b3e8c66bc7ad
# Authors: Alexandre Gramfort <alexandre.gramfort@telecom-paristech.fr> # Matti Hamalainen <msh@nmr.mgh.harvard.edu> # # License: BSD (3-clause) import numpy as np import os import os.path as op from scipy import sparse, linalg from copy import deepcopy from .io.constants import FIFF from .io.tree import dir...
rajegannathan/grasp-lift-eeg-cat-dog-solution-updated
python-packages/mne-python-0.10/mne/source_space.py
Python
bsd-3-clause
101,801
[ "Mayavi" ]
adf97e9266371011a3b81f597a3fc6ae7df64cde7630ebd729a25cd8586ca995
# -*- Mode: python; tab-width: 4; indent-tabs-mode:nil; coding:utf-8 -*- # vim: tabstop=4 expandtab shiftwidth=4 softtabstop=4 # # MDAnalysis --- https://www.mdanalysis.org # Copyright (c) 2006-2017 The MDAnalysis Development Team and contributors # (see the file AUTHORS for the full list of names) # # Released under t...
MDAnalysis/mdanalysis
package/MDAnalysis/lib/NeighborSearch.py
Python
gpl-2.0
4,718
[ "MDAnalysis" ]
8fb118bb51186202d879fbea2d1e4485c71ff33342424106f4fa8c45279ba1c7
# coding: utf-8 """ This module defines the events signaled by abinit during the execution. It also provides a parser to extract these events form the main output file and the log file. """ from __future__ import unicode_literals, division, print_function import sys import os.path import datetime import collections im...
rousseab/pymatgen
pymatgen/io/abinitio/events.py
Python
mit
28,120
[ "ABINIT", "NetCDF", "pymatgen" ]
5cb0e594a51daee1c551e16f31460119a28a9b434a508296385c8daeaae164b3
################################################################################ # SCFGP: Sparsely Correlated Fourier Features Based Gaussian Process # Github: https://github.com/MaxInGaussian/SCFGP # Author: Max W. Y. Lam (maxingaussian@gmail.com) ####################################################################...
MaxInGaussian/SCFGP
experiments/kin8nm/test_regression.py
Python
bsd-3-clause
1,832
[ "Gaussian" ]
6473d03bd0e211e062c20947aa33f75679b501033eeab4b1ad16ddb0bdd55a7f
#!/usr/bin/python # -*- coding: utf-8 -*- '''General routines shared between decoders ''' # Copyright © 2013 Kevin Thibedeau # This file is part of Ripyl. # Ripyl 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...
kevinpt/ripyl
ripyl/decode.py
Python
lgpl-3.0
48,118
[ "Gaussian" ]
fc2994fc570f73cee242ccaf758b84bb0e9c6f1348e41b988f780cd92d48963a
# Pizza.py toolkit, www.cs.sandia.gov/~sjplimp/pizza.html # Steve Plimpton, sjplimp@sandia.gov, Sandia National Laboratories # # Copyright (2005) Sandia Corporation. Under the terms of Contract # DE-AC04-94AL85000 with Sandia Corporation, the U.S. Government retains # certain rights in this software. This software is...
eddiejessup/pizza
src/data.py
Python
gpl-2.0
12,483
[ "LAMMPS" ]
f48dd58365b09edef1a3b80e3cf02489368804009fd03f70defbb151b5b6f17d
""" @name: Modules/Core/Utilities/_test/test_coordinate_tools.py @author: D. Brian Kimmel @contact: d.briankimmel@gmail.com @copyright: 2016-2019 by D. Brian Kimmel @date: Created on Jun 21, 2016 @licencse: MIT License @summary: Passed all 5 tests - DBK 2016-11-22 """ __updated__ = '2019-09-07'...
DBrianKimmel/PyHouse
Project/src/Modules/Core/Utilities/_test/test_coordinate_tools.py
Python
mit
1,987
[ "Brian" ]
a34f575f3da7907305262bf5fb8af7cf744ff17fe648f3e3ac2c2ccdfa2b1961
""" # Notes: - This simulation seeks to emulate the COBAHH benchmark simulations of (Brette et al. 2007) using the Brian2 simulator for speed benchmark comparison to DynaSim. However, this simulation includes CLOCK-DRIVEN synapses, for direct comparison to DynaSim's clock-driven architecture. The synaptic connec...
asoplata/dynasim-benchmark-brette-2007
output/Brian2/brian2_benchmark_COBAHH_clocksyn_lodens_0004/brian2_benchmark_COBAHH_clocksyn_lodens_0004.py
Python
gpl-3.0
3,772
[ "Brian" ]
0e60a10162104b807e8efc284dd5f1ae1d6c8ebf566ea5504c8484f879d47057
#!/usr/bin/env python from subprocess import call import shutil import simplejson from collections import OrderedDict import os from GitBoil import Boil ### TODO # make README.md blank # update key words # https://github.com/jamesrhaley/es2015-babel-gulp-jasmine.git new_name = raw_input("what should the project be c...
jamesrhaley/boilJS
boil_JS.py
Python
mit
1,987
[ "GULP" ]
18467e4bb4ca661a10e125dc9dea12db1d06426080aedf1c27adc81a1b68b315
import rdkit.Chem.GraphDescriptors as RDKit from ._base import Descriptor from ._graph_matrix import DistanceMatrix __all__ = ("BalabanJ",) class BalabanJ(Descriptor): r"""Balaban's J index descriptor(rdkit wrapper).""" since = "1.0.0" __slots__ = () def description(self): return "Balaban'...
mordred-descriptor/mordred
mordred/BalabanJ.py
Python
bsd-3-clause
733
[ "RDKit" ]
ab2f287bbdb154553547cbf770b682b1367078e250b22e082ada5d7577ba906d