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# Copyright (c) Pymatgen Development Team. # Distributed under the terms of the MIT License. import os import unittest import warnings from shutil import which import numpy as np from monty.serialization import loadfn from pymatgen.analysis.magnetism import ( CollinearMagneticStructureAnalyzer, MagneticStruc...
materialsproject/pymatgen
pymatgen/analysis/magnetism/tests/test_analyzer.py
Python
mit
13,067
[ "pymatgen" ]
01e724333154f94367cc17913c1c9d247fb70f0b1a09f620cdd2b182598c64c2
# Copyright 2017 Google Inc. All Rights Reserved. # # Licensed under the Apache License, Version 2.0 (the "License"); # you may not use this file except in compliance with the License. # You may obtain a copy of the License at # # http://www.apache.org/licenses/LICENSE-2.0 # # Unless required by applicable law or a...
tensorflow/transform
tensorflow_transform/analyzers.py
Python
apache-2.0
109,671
[ "Gaussian" ]
b945fb17be09920bd5170f54e9040f1ff4947d8f9084cd379ffd5693c0be2006
# Orca # # Copyright 2013 The Orca Team. # # This library is free software; you can redistribute it and/or # modify it under the terms of the GNU Lesser General Public # License as published by the Free Software Foundation; either # version 2.1 of the License, or (at your option) any later version. # # This library is ...
ruibarreira/linuxtrail
usr/lib/python3/dist-packages/orca/scripts/apps/gnome-documents/speech_generator.py
Python
gpl-3.0
1,530
[ "ORCA" ]
b8120e91f9de3450988c10b01a69a412cf64fe2f64d0bab8e5ed3070efcd5086
import pandas as pd import numpy as np mets = ['A','B','C','D','E','F','A_ext', 'D_ext', 'E_ext','F_ext'] internal_mets = [m for m in mets if 'ext' not in m] rxns = ['R_{}'.format(i) for i in range(1,10)] data = {'R_1': pd.Series({'A':1, 'A_ext': -1}), 'R_2': pd.Series({'A':-1,'B':1}), 'R_3': pd.Series(...
djinnome/mentos
mentos/abc_model.py
Python
gpl-3.0
2,191
[ "Avogadro" ]
6d6c7ead70b9a416d565b9b8cb0b4b6f6bb196ec43a6609a6d447f5d049bbb95
# Orca # # Copyright 2010 Joanmarie Diggs. # # This library is free software; you can redistribute it and/or # modify it under the terms of the GNU Library General Public # License as published by the Free Software Foundation; either # version 2 of the License, or (at your option) any later version. # # This library is...
GNOME/orca
src/orca/scripts/apps/gnome-panel/speech_generator.py
Python
lgpl-2.1
2,321
[ "ORCA" ]
d308935b73fd2289f753bfaddcfeb14cc43de8735d1e577dc7a0c590cd0113c8
import pyNN.nest as sim #import pyNN.neuron as sim import pyNN.utility import numpy as np import sys from parameters import * from matplotlib import pyplot as plt def save_spikes(pop_list, base_name, filename): for idx, pop in enumerate(pop_list): print idx, pop spikes = pop.getSpikes() pr...
pierreberthet/demo2.2-bg
pynn/simplified_bg_pynn.py
Python
gpl-2.0
9,657
[ "NEURON" ]
f4c91ac4f0c85dd4d10f8bc59c3b60a6fe6a0be287d65302b3dc0d3f23e7fdc1
############################################################################## # adaptiveMD: A Python Framework to Run Adaptive Molecular Dynamics (MD) # Simulations on HPC Resources # Copyright 2017 FU Berlin and the Authors # # Authors: Jan-Hendrik Prinz # Contributors: # # `adaptiveMD` is free software: ...
markovmodel/adaptivemd
adaptivemd/scheduler.py
Python
lgpl-2.1
10,021
[ "MDTraj" ]
4485cde8b8f00dc312476f68a3b108daef90d3efbe93c44699be58ac35c00b28
# class to get get data from OpenBooks import httplib2 import json import sqlalchemy from copy import deepcopy from oauth2client import file, client, tools from octopus.core import app, initialise from service.database import db, FA_API_TABLES from service.lib import util class Sync(object): SCOPES = 'CottageLab...
CottageLabs/finance
service/lib/sync.py
Python
apache-2.0
8,570
[ "Octopus" ]
323f1065973e3d418dec499c93dedb26315062cd12896d11c28982c65fbb54e3
# coding=utf-8 """ Protein-Ligand Interaction Profiler - Analyze and visualize protein-ligand interactions in PDB files. test_metal_coordination.py - Unit Tests for Metal Coordination. """ import unittest from plip.structure.preparation import PDBComplex class MetalCoordinationTest(unittest.TestCase): """Check...
ssalentin/plip
plip/test/test_metal_coordination.py
Python
gpl-2.0
6,129
[ "CRYSTAL" ]
289b96132e652c98dc8b93ba4e7eec5ea74a8ed9ed8982f3cb82b1a5259674ca
# This file is part of Bioy # # Bioy 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. # # Bioy is distributed in the hope...
nhoffman/bioy
bioy_pkg/subcommands/csvdeduplicate.py
Python
gpl-3.0
2,842
[ "BLAST" ]
fb8d3d289069c6b559ab86822d6e8097818b55642051be11dc51ea7456ea2d25
#!/usr/bin/python2 from distutils.core import setup import os import sys # config file data_files = [("/etc/lorax", ["etc/lorax.conf"])] # shared files for root, dnames, fnames in os.walk("share"): for fname in fnames: data_files.append((root.replace("share", "/usr/share/lorax", 1), ...
dashea/lorax
setup.py
Python
gpl-2.0
1,203
[ "Brian" ]
5ff4c3d850cc2842f90c273c952ad4d620aa6b1d18ce62feb8667cf996312d44
import numpy as np import pandas as pd import mdtraj as md trj0 = md.load("./system.subset.pdb") top, bonds = trj0.top.to_dataframe() i0 = np.where((top.name == "CB") & (top.resSeq == 310))[0][0] i1 = np.where((top.name == "CB") & (top.resSeq == 409))[0][0] indices = np.array([[i0, i1]]) n_traj = 131 all_distances ...
hainm/MSMs
attic/src/code/hmsm/compute_distances.py
Python
gpl-2.0
559
[ "MDTraj" ]
498bc73a1c5693aedfd9f63c3127f785fd194621b3aacaf2495debd258bfbf96
# Copyright (C) 2010 CAMd # Please see the accompanying LICENSE file for further information. """This module provides all the classes and functions associated with the evaluation of exact exchange with k-point sampling.""" from time import time from math import pi, sqrt import numpy as np from ase.utils import prnt...
robwarm/gpaw-symm
gpaw/xc/hybridg.py
Python
gpl-3.0
28,354
[ "ASE", "GPAW", "Gaussian" ]
87a8469e02bd09a69d7eacf024b809f44eced666e0b22511aa45966285eb8f0b
"""Tests for Trees and Leaves. """ import pytest import os import py import datreant as dtr from datreant import Veg, Leaf, Tree, Treant class TestVeg(object): """Common element tests of Trees and Leaves""" cls = Veg name = 'veggie' @pytest.fixture def veg(self, tmpdir): with tmpdir.as...
dotsdl/datreant
src/datreant/tests/test_trees.py
Python
bsd-3-clause
12,837
[ "MOE" ]
93aa7812a68a6e618cf686329d6261706635b631fd095f7f43408fa3f34c7c7a
# -*- coding: utf-8 -*- # # Collection of functions related to BAM and SAM files # # pysam uses 0-based coordinates from past.builtins import xrange from collections import namedtuple import os import re import sys import pysam from . import compat from . import exceptions from . import g2g from . import g2g_utils...
churchill-lab/g2gtools
g2gtools/bsam.py
Python
mit
41,302
[ "pysam" ]
9c536a45c8b838834723db0447896a24be9eb945d60073ab580d85fc407d06c8
""" Sequence classes """ import data import logging import re import string from cgi import escape from galaxy.datatypes.metadata import MetadataElement from galaxy.datatypes import metadata import galaxy.model from galaxy import util from sniff import * log = logging.getLogger(__name__) class Sequence( data.Text ):...
volpino/Yeps-EURAC
lib/galaxy/datatypes/sequence.py
Python
mit
21,504
[ "BLAST", "BioPerl", "Galaxy" ]
f9d07a3b9fe9386efb4bb9b56b1f2f1f90cdbd0551221bae3cc4479ed68d55a2
from .. import Provider as PersonProvider class Provider(PersonProvider): formats_female = ( '{{first_name_female}} {{last_name}}', '{{first_name_female}} {{last_name}}', '{{first_name_female}} {{last_name}}', '{{first_name_female}} {{last_name}}', '{{first_name_female}} {{...
danhuss/faker
faker/providers/person/en/__init__.py
Python
mit
86,729
[ "Amber", "Brian", "COLUMBUS", "CRYSTAL", "Dalton", "Desmond", "MOE" ]
e079965bbc80bb3e25cc4efc17e35660d25522f769a6c95a6398ced8b9450bcb
"""Calculator for General Energy-based Fragmentation""" from sys import stdout from ase.units import Ha from ase.calculators.nwchem import NWChem from numpy import zeros, append, array, transpose, savetxt, abs #maybe later we can make let it inherit from the Calculator base class class GEBF(object): """Initialize...
PHOTOX/fuase
ase/ase/calculators/gebf-separate-calc.py
Python
gpl-2.0
8,324
[ "ASE", "NWChem" ]
a6516ffa73acf8dc3658b4983380563196cfdead1fe15cd3e4c3e6f9e0ffd98d
# -*- coding: utf-8 -*- from __future__ import unicode_literals from django.db import models, migrations import easy_thumbnails.fields import multiselectfield.db.fields class Migration(migrations.Migration): dependencies = [ ('main', '0035_auto_20141204_1708'), ] operations = [ migratio...
MaximeBiset/care4care
main/migrations/0036_auto_20141204_1818.py
Python
agpl-3.0
1,581
[ "VisIt" ]
c809e115024d018ab4664f37837b2cffe98284e10544a8dd513b081dea2ab4c5
# Copyright 2019 The Magenta 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 in ...
jesseengel/magenta
magenta/models/sketch_rnn/rnn.py
Python
apache-2.0
16,509
[ "Gaussian" ]
175a0b305042af5e77e52fa7047caf0f23a21a4014b43e63b0faafe7caf09f4a
# Copyright (C) 2010-2018 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 v...
mkuron/espresso
testsuite/python/stress.py
Python
gpl-3.0
14,010
[ "ESPResSo" ]
427cc4afe60320ed508ccd75dccb3e97810a05b17fee98c4328627664189ff41
""" A simple BioPython converter to move from phylip to clustal formats for the alignments """ import os import sys import argparse from Bio import SeqIO if __name__ == '__main__': parser = argparse.ArgumentParser(description="Convert an alignment file from phylip format to clustal format") parser.add_argume...
linsalrob/EdwardsLab
crAssphage/phylip2clustal.py
Python
mit
713
[ "Biopython" ]
eccf35c49793f139455d1b2403344c3a8fd81bf143c1af59265f1f1cd1ce501a
# 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...
kkreis/espressopp
src/interaction/HarmonicUnique.py
Python
gpl-3.0
3,865
[ "ESPResSo" ]
c01d34318bda13bd8dba864478129d475451acb394c1e4486f62fdc7efca51d4
#!/usr/bin/env python import re,urllib2 class Get_public_ip: def getip(self): try: myip = self.visit("http://ipv4.icanhazip.com/") except: try: myip = self.visit("http://www.whereismyip.com/") except: myip = "So sorry!!!" re...
youprofit/lnmp
include/get_public_ipaddr.py
Python
apache-2.0
604
[ "VisIt" ]
7a7b1e2d513014662a497b2b1bbb36c2b9d4a2b350b7613b297db190536cf2a4
# Authors: Matti Hämäläinen <msh@nmr.mgh.harvard.edu> # Alexandre Gramfort <alexandre.gramfort@inria.fr> # # License: BSD (3-clause) # Many of the computations in this code were derived from Matti Hämäläinen's # C code. from copy import deepcopy from functools import partial from gzip import GzipFile import ...
kambysese/mne-python
mne/source_space.py
Python
bsd-3-clause
127,142
[ "Mayavi" ]
991f435452f13b17d0e0ceb882991c10d6988fe25ed5f00b4e8b4dfe3842fbfd
''' Test_RSS_Command_VOBOXAvailabilityCommand ''' import unittest import mock import DIRAC.ResourceStatusSystem.Command.VOBOXAvailabilityCommand as moduleTested __RCSID__ = '$Id: $' ################################################################################ class VOBOXAvailabilityCommand_TestCase( unittest....
andresailer/DIRAC
ResourceStatusSystem/Command/test/Test_RSS_Command_VOBOXAvailabilityCommand.py
Python
gpl-3.0
3,435
[ "DIRAC" ]
9a5c18cd237d7f44d2b8e414a71682a11fa1aa2ac9a3131d80d64391863ccbe6
"""Introduction ^^^^^^^^^^^^ The likelihood is :math:`p(y|f,X)` which is how well we will predict target values given inputs :math:`X` and our latent function :math:`f` (:math:`y` without noise). Marginal likelihood :math:`p(y|X)`, is the same as likelihood except we marginalize out the model :math:`f`. The importance...
SheffieldML/GPy
GPy/likelihoods/__init__.py
Python
bsd-3-clause
1,494
[ "Gaussian" ]
2a59407a79f4cb18e43a46117a95359732d6587bc96d21a815346fed0aeb6f3b
""" This is a test of the chain PilotsLoggingClient -> PilotsLoggingHandler -> PilotsLoggingDB It supposes that the DB is present, and that the service is running """ import unittest from DIRAC.WorkloadManagementSystem.Client.PilotsLoggingClient import PilotsLoggingClient from DIRAC.Core.Base.Script import p...
arrabito/DIRAC
tests/Integration/WorkloadManagementSystem/Test_PilotsLoggingClient.py
Python
gpl-3.0
5,238
[ "DIRAC" ]
f5917dd3485b1cdd550e054b32fcf282b8d9892ae9ba3945826387e216b2e0e9
#!/usr/bin/env python """ Copyright (c) 2006-2017 sqlmap developers (http://sqlmap.org/) See the file 'doc/COPYING' for copying permission """ import codecs import contextlib import cookielib import copy import getpass import hashlib import httplib import inspect import json import locale import logging import ntpath...
michaelhidalgo/7WCSQ
Tools/SQLMap/sqlmap/lib/core/common.py
Python
apache-2.0
145,010
[ "VisIt" ]
f6f85e20e97537725c8ee28b6fc84cf7a98c7bd7e6d2a78fed6b4589f5e9ef7d
#!/usr/bin/python # -*- coding: utf-8 -*- # # --- BEGIN_HEADER --- # # mrslview - [insert a few words of module description on this line] # Copyright (C) 2003-2009 The MiG Project lead by Brian Vinter # # This file is part of MiG. # # MiG is free software: you can redistribute it and/or modify # it under the terms of ...
heromod/migrid
mig/cgi-bin/mrslview.py
Python
gpl-2.0
1,104
[ "Brian" ]
16dbf75596e9fa446047c6e2287b7efd4142f3daa096d0698a8dfc4e56db9620
# Copyright 2013-2021 Lawrence Livermore National Security, LLC and other # Spack Project Developers. See the top-level COPYRIGHT file for details. # # SPDX-License-Identifier: (Apache-2.0 OR MIT) from spack import * class RVariantannotation(RPackage): """Annotation of Genetic Variants Annotate variants,...
LLNL/spack
var/spack/repos/builtin/packages/r-variantannotation/package.py
Python
lgpl-2.1
3,666
[ "Bioconductor" ]
cc5509f7ed557e2764e68ce2fc59e2cf392b976eb906dca9782eedc3931e240d
import os import sys import csv import datetime import configparser from cappy import API from nacc.uds3.filters import * # Creating a folder which contains Intermediate files def recent_run_folder(out_dir): # Check if directory exists. If not, create it. if not os.path.exists(out_dir): try: ...
ctsit/nacculator
nacc/run_filters.py
Python
bsd-2-clause
5,622
[ "VisIt" ]
70fa58f58db217a31ae8edf5c7dd68922135e0a162fd090545572f14fd507880
#!/usr/bin/env python # Copyright (C) 2014 Open Data ("Open Data" refers to # one or more of the following companies: Open Data Partners LLC, # Open Data Research LLC, or Open Data Capital LLC.) # # This file is part of Hadrian. # Licensed under the Apache License, Version 2.0 (the "License"); # you may not use this...
opendatagroup/hadrian
titus/titus/pmml/version_independent.py
Python
apache-2.0
70,112
[ "NEURON" ]
32ea078585f6eedfedfdf332f5880bb047ef92d198afbdbdeaeee957100b2fab
from __future__ import print_function import os.path import re import sys import tarfile import time from datetime import datetime # pylint: disable=unused-import,g-bad-import-order import tensorflow.python.platform from six.moves import urllib import numpy as np import tensorflow as tf # pylint: enable=unused-import,...
IsThatYourBag/IsThatYourBag
scripts/convert_inception_v3.py
Python
mit
19,027
[ "Gaussian" ]
f5555f3fb33391d68624ea63b48bb3b1a94b5b7c90c13a13d9e6dad153980fca
#!/usr/bin/env python3 # -*- coding: utf-8 -*- """ An EM algorithm for GMMs """ import numpy as np import scipy as sc import scipy.misc import scipy.spatial import scipy.linalg from numpy import array, eye, ones, log from scipy.linalg import norm cdist = scipy.spatial.distance.cdist logsumexp = scipy.logaddexp.reduce...
arunchaganty/presidential-debates
django/twit/GaussianMixtureClustering.py
Python
mit
2,611
[ "Gaussian" ]
64779dab973f38bf9e854835b636bed6966c14d1cd4b17a5e7cde509d2b1f7de
# -*- coding: utf-8 -*- # HORTON: Helpful Open-source Research TOol for N-fermion systems. # Copyright (C) 2011-2015 The HORTON Development Team # # This file is part of HORTON. # # HORTON is free software; you can redistribute it and/or # modify it under the terms of the GNU General Public License # as published by th...
eustislab/horton
horton/io/cp2k.py
Python
gpl-3.0
8,458
[ "CP2K", "Gaussian" ]
e6513b66306820767c6f7028997ede1a5ee00eabdd9d0b99c3aa11faf2a04702
from ase import Atoms from gpaw import GPAW, PW h = Atoms('H', cell=(5, 5, 5)) h.center() h.calc = GPAW(setups='ae', txt='H.ae.txt') for ecut in range(200, 1001, 100): h.calc.set(mode=PW(ecut)) e = h.get_potential_energy()
robwarm/gpaw-symm
doc/tutorials/hydrogen/h.py
Python
gpl-3.0
231
[ "ASE", "GPAW" ]
d2f026c85cff2254b5c501fd6be0dff707da3252851dfea987a967a90936bea1
__DESCRIPTION__="""2d Gauss Fit of a single gaussian The model function would be R=[ [ cos(psi_ell),sin(psi_ell)] [-sin(psi_ell),cos(psi_ell)] ] C=diag(lambda0,lambda1) R0 = (x0;y0) is log(y)=-0.5*(A*x**2+2*B*x*y+C*y**2+K+E*x+F*y) the fwhm of two axis comes from eigenvectors of matrix AA=[[A,B],[B,C]] the center ...
MicheleMaris/GaussFit
__init__.py
Python
gpl-2.0
36,001
[ "Gaussian" ]
b572855b86362e633cf94451a2d71663ee052d31fb1b355bc93c020a1b5b14ed
import io import time import click import pysam import logging logger = logging.getLogger(__name__) @click.command() @click.argument('inbam', type=click.Path(exists=True)) @click.argument('fastq', type=click.Path()) @click.option('--mq-threshold', type=click.IntRange(min=0, max=255), help='Skip reads below this thr...
latticelabs/Mitty
mitty/benchmarking/convert_bam_to_truth_fastq.py
Python
gpl-2.0
3,742
[ "pysam" ]
aa3bea74a84a0901344a83c653b1316d213284b00827cfd3bd64d01815156899
from api.models import Photo, Face, AlbumDate, Person from django.db.models import Prefetch from api.serializers_serpy import AlbumDateListWithPhotoHashSerializer as AlbumDateListWithPhotoHashSerializerSerpy from api.serializers import AlbumDateListWithPhotoHashSerializer as AlbumDateListWithPhotoHashSerializer import...
hooram/ownphotos-backend
api/bench.py
Python
mit
10,303
[ "Gaussian" ]
d6c000aebf47dd6032abc3cf93267dc3d68d7bdb4e8452c5ee14073f118b14b3
import os import sys import time import glob import shutil import argparse from mpi4py import MPI class ParallelMDruns(object): ##TICA def write_script(self, script, directory, rank, mdpfile, grofile, topfile, output_grofile, start_coord, num_coord, tprfile='topol.tpr', trrfile='traj.trr', edrfile='ener.edr',...
jp43/lsdmap
dmdmd/tools/p_mdrun.py
Python
bsd-3-clause
10,815
[ "Gromacs" ]
91c656dd10cb37db37ff02e3aca59b43a92fcde58259347fb27d478bfb90ad5f
######################################################################## # File: FileCatalogHandler.py ######################################################################## """ :mod: FileCatalogHandler .. module: FileCatalogHandler :synopsis: FileCatalogHandler is a simple Replica and Metadata Catalog service """...
ic-hep/DIRAC
src/DIRAC/DataManagementSystem/Service/TornadoFileCatalogHandler.py
Python
gpl-3.0
1,737
[ "DIRAC" ]
ba7a5da65407bf9eabf6b36932b6d0d4a4e3d8283c6ed5402b28f0cbae5e35d9
import pytest from time import time import capybara from capybara.exceptions import ElementNotFound from capybara.tests.helpers import extract_results class CheckTestCase: @pytest.fixture(autouse=True) def setup_session(self, session): session.visit("/form") class TestCheck(CheckTestCase): def ...
elliterate/capybara.py
capybara/tests/session/test_check.py
Python
mit
6,858
[ "Jaguar", "VisIt" ]
59fd8a240f9585da12641ff2effbc70dcc07b1cedaf7093f112a649ab78e6f63
""" Differential evolution """ import numpy def de(output_basename, parameter_names, transform, loglikelihood, prior, nsteps=40000, vizfunc=None, printfunc=None, **problem): """ **Differential evolution** via `inspyred <http://inspyred.github.io/>`_ specially tuned. steady state replacement, n-point crosso...
JohannesBuchner/jbopt
jbopt/de.py
Python
bsd-2-clause
4,824
[ "Gaussian" ]
16760569d23cefbd65f35d6cb5f02f4f7c336b3aa6793ee021c3ab1347de6b08
# coding: utf-8 # Copyright (c) Pymatgen Development Team. # Distributed under the terms of the MIT License. import gzip import json import os import unittest import warnings import xml.etree.cElementTree as ET from pathlib import Path from shutil import copyfile, copyfileobj import numpy as np import pytest from mo...
richardtran415/pymatgen
pymatgen/io/vasp/tests/test_outputs.py
Python
mit
87,130
[ "VASP", "Wannier90", "pymatgen" ]
ac23ee560be84b7b750fb5083ff7312ec22f4399dc447433efb4e8792aef3de1
# Copyright 1999 by Jeffrey Chang. 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. # Patched by Brad Chapman. # Chris Wroe added modifications for work in myGrid """ This modul...
dbmi-pitt/DIKB-Micropublication
scripts/mp-scripts/Bio/Blast/NCBIWWW.py
Python
apache-2.0
33,660
[ "BLAST", "Biopython" ]
a9ca876fbbef7a938d72b20a25d7ddd2c56dda4124e4252243e987df51827e92
# coding: utf-8 import nipype.pipeline.engine as pe import nipype.interfaces.utility as niu import nipype.interfaces.fsl as fsl import os def create_dmri_preprocessing(name='dMRI_preprocessing', use_fieldmap=True, fieldmap_registration=False): """Creates a workflow that chains the necessary pipelines to corre...
dmordom/nipype
nipype/workflows/dmri/fsl/epi.py
Python
bsd-3-clause
34,579
[ "Gaussian" ]
d913b471ce26bc4463fb7ec3d820fbd411dd0276a07388c74e2606fdc9ecf0aa
# coding=utf-8 """ Python AST visitor that converts an expression to a RACO equivalent """ import sys import ast from raco.expression import NamedAttributeRef, UnnamedAttributeRef, \ StringLiteral, NumericLiteral, BooleanLiteral, \ EQ, NEQ, LT, LTEQ, GT, GTEQ, AND, OR, NOT, \ PLUS, MINUS, DIVIDE, IDIVIDE,...
uwescience/raco
raco/python/util/visitor.py
Python
bsd-3-clause
11,005
[ "VisIt" ]
e43fae8ad2bea1113969cde6f78074ad09a1dc05a0bde7f6b4a19875c75bae6b
# # # # # # # # # # # # # # # # # # # # # # # # # # # # # # # # # # # # # # # # # Okinawa Institute of Science and Technology, Japan. # # This script runs on STEPS 2.x http://steps.sourceforge.net # # H Anwar, I Hepburn, H Nedelescu, W Chen and E De Schutter # Stochastic calcium mechanisms cause dendritic calcium spike...
CNS-OIST/STEPS_Example
publication_models/API_2/Anwar_J_Neurosci_2013/HybridCaburst_stochCaT.py
Python
gpl-2.0
19,678
[ "Avogadro" ]
d6f679d314265fe9aaba8a6f675ce800dc977dcac79855da6759380a22b349c0
#------------------------------------------------------------------------------- # Copyright (c) 2012 Gael Honorez. # All rights reserved. This program and the accompanying materials # are made available under the terms of the GNU Public License v3.0 # which accompanies this distribution, and is available at # htt...
IDragonfire/modular-client
src/trueSkill/TrueSkill/TruncatedGaussianCorrectionFunctions.py
Python
gpl-3.0
5,615
[ "Gaussian" ]
6b0376ffdb2bcf51e5dc3ad46caf0c7004a5056f134c6c986dc2a21c0a3319ba
# -*- coding: utf-8 -*- """ This sample demonstrates a simple skill built with the Amazon Alexa Skills Kit. The Intent Schema, Custom Slots, and Sample Utterances for this skill, as well as testing instructions are located at http://amzn.to/1LzFrj6 For additional samples, visit the Alexa Skills Kit Getting Started guid...
Ernestyj/PyStudy
alexa-smarthome/sample_lambda/lambda_function_guess_number.py
Python
apache-2.0
23,635
[ "VisIt" ]
cfc81585b34a87b50ad785ddf48909f44b7f5b227251926f3b7f2b38f2404419
config = { # environment this app is running on: localhost, testing, production 'environment': "production", # webapp2 sessions 'webapp2_extras.sessions' : {'secret_key': '_PUT_KEY_HERE_YOUR_SECRET_KEY_'}, # webapp2 authentication 'webapp2_extras.auth' : {'user_model': 'boilerplate.models.User', ...
rittersport3/CityWatchers
config/production.py
Python
lgpl-3.0
4,100
[ "VisIt" ]
bf131474c6114efd29da608be4e4d55d1d86f0fcfae63e4f585d42e9269c43c8
# proxy module from __future__ import absolute_import from mayavi.components.custom_grid_plane import *
enthought/etsproxy
enthought/mayavi/components/custom_grid_plane.py
Python
bsd-3-clause
104
[ "Mayavi" ]
73dc44ceb7913ee85d2bd76a6e763d9ecb63da3cd6ca4af9775b8a372e065980
# coding: utf-8 from __future__ import unicode_literals import base64 import binascii import collections import ctypes import email import getpass import io import itertools import optparse import os import platform import re import shlex import shutil import socket import struct import subprocess import sys import xm...
vinegret/youtube-dl
youtube_dl/compat.py
Python
unlicense
93,865
[ "Bowtie" ]
b92f55bca4dee05d2a3cfc051d2e41513d28dabc7d231be615ef5462b0a15994
r""" Tools for seismic inversion: migration **Auxiliary functions** * :func:`~fatiando.seismic.zft_rtm`: apply 2D reverse time depth migration in a Zero-oFfseT section * :func:`~fatiando.seismic.shot_rtm`: apply 2D reverse time depth migration in a shot gather Those implementations use explicit finite differences t...
eusoubrasileiro/fatiando_seismic
fatiando/seismic/migration.py
Python
bsd-3-clause
13,102
[ "Gaussian" ]
d7ab2a2ad53b3baec88e2e0f902238987f571ead6ec1713987426c87226fb550
# dialog.py --- A Python interface to the ncurses-based "dialog" utility # -*- coding: utf-8 -*- # # Copyright (C) 2002, 2003, 2004, 2009, 2010, 2013, 2014, 2015 Florent Rougon # Copyright (C) 2004 Peter Åstrand # Copyright (C) 2000 Robb Shecter, Sultanbek Tezadov # # This library is free software; you can redistrib...
skalkoto/pythondialog
dialog.py
Python
lgpl-2.1
150,922
[ "VisIt" ]
3391ea81d69fc5e6b5af8d773f7b8f8b345af83ebcfb49798e96f0931a237d35
import argparse import os import subprocess from pocket_api import Pocket, PocketException from pocket import refresh_list from workflow import Workflow import config WF = Workflow() POCKET_URL = 'http://getpocket.com/a/read/%s' def execute(): args = parse_args(WF.args) if args.query is None: print...
danielma/dotfiles
Alfred/Alfred.alfredpreferences/workflows/user.workflow.8EEBA440-B5C0-4FCB-B302-C69767A65CB6/pocket_launcher.py
Python
mit
3,561
[ "VisIt" ]
75f99eb4fa367d35d5dfaa866896bd2db8f1d94c7385fd9ed0209cbacac5f3cd
'''Transform operation on globally scoped symbols to operations on symbol_cell mapping. ''' from __future__ import absolute_import from __future__ import with_statement from ..runtime.symbol import get_symbol_cells_map, gensym from ..compiler import ir as I from ..compiler import bind from ..compiler.walk import I...
matthagy/Jamenson
jamenson/transform/globals.py
Python
apache-2.0
4,950
[ "VisIt" ]
3c661e5ebfc4a00ba36f20f3671a81b0c8a2f475eb1f9d3ae6b7d13a0c21e823
''' Simple catalog ''' import numpy as np from hvs import HVSsample, Contigiani2018 ''' Create ejection catalog ''' # Initialize an ejection model, in this case the default Contigiani2018 with a minor namne customization ejectionmodel = Contigiani2018(name_modifier='TEST') # The name will appear in the final...
contigiani/hvs
examples/myfirstcatalog.py
Python
gpl-3.0
1,114
[ "Galaxy" ]
d2f6c6a394625d254d309967106b2474a0d64b33efbd2e972aea6b9b623421d7
import numpy as np ### Defining the single-peak Gaussian function def Single_Gaussian(params, x): x0 = params[0] intensity = params[1] FWHM = params[2] bkgnd = params[3] return float(intensity)*np.exp(- 0.5*((x0-x)/(FWHM/2.355))**2) + bkgnd def Single_Gaussian_integrand(x,...
karamarielynch/dss-df
lineshape.py
Python
mit
2,359
[ "Gaussian" ]
1d4cafc5787206bc96caf41380509d8c8998bd4aba9f2ce4c0625368d5bf6220
# Copyright 2013-2020 Lawrence Livermore National Security, LLC and other # Spack Project Developers. See the top-level COPYRIGHT file for details. # # SPDX-License-Identifier: (Apache-2.0 OR MIT) import os import sys from spack import * class Lbann(CMakePackage, CudaPackage): """LBANN: Livermore Big Artificial ...
rspavel/spack
var/spack/repos/builtin/packages/lbann/package.py
Python
lgpl-2.1
11,820
[ "VTK" ]
ced4f315c9294ff08559504d86fa48c01281aa1358c709bd8d72fc984713c0ee
""" GOCDBClient module is a client for the GOC DB, looking for Downtimes. """ __RCSID__ = "$Id$" import urllib2 import time import socket from datetime import datetime, timedelta from xml.dom import minidom from DIRAC import S_OK, S_ERROR, gLogger def _parseSingleElement( element, attributes = None ): """ Given...
sposs/DIRAC
Core/LCG/GOCDBClient.py
Python
gpl-3.0
11,129
[ "DIRAC" ]
320420c1d2c1905d1e5479eba454f29eb00177ae59fd08689e99ddfce6c5fa7e
# Orca # # Copyright 2010 Joanmarie Diggs. # # This library is free software; you can redistribute it and/or # modify it under the terms of the GNU Library General Public # License as published by the Free Software Foundation; either # version 2 of the License, or (at your option) any later version. # # This library is...
Alberto-Beralix/Beralix
i386-squashfs-root/usr/share/pyshared/orca/scripts/apps/gnome-panel/speech_generator.py
Python
gpl-3.0
2,264
[ "ORCA" ]
07d5c2879ff7c55fb900325005067fe4449352301680384da031f145776b9822
# Copyright 2018 Open Source Robotics Foundation, Inc. # # 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...
ros2/launch
launch/test/launch/test_execute_process.py
Python
apache-2.0
8,098
[ "VisIt" ]
66ecd44b1fbef167b6dd26ad661bb264a62dca283cc67ebffceb2a95e9d01319
import json import operator import pytest from flask import Blueprint, Flask, g, jsonify, request from flask.views import MethodView from flask_allows import ( Additional, Allows, And, C, Not, Or, Override, Permission, Requirement, exempt_from_requirements, guard_entire, ...
justanr/flask-allows
test/test_integration.py
Python
mit
13,379
[ "Brian" ]
b992f6de17fa511ae827783250e55454d35aabe0cbd28244f84e5e9b53ddb8d1
"""Demonstrates molecular dynamics with constant energy.""" from ase.lattice.cubic import FaceCenteredCubic from ase.md.velocitydistribution import MaxwellBoltzmannDistribution from ase.md.verlet import VelocityVerlet from ase import units # Use Asap for a huge performance increase if it is installed use_asap = True ...
misdoro/python-ase
doc/tutorials/md/moldyn2.py
Python
gpl-2.0
1,464
[ "ASE", "CRYSTAL" ]
15502fe9798de9c8e6013a853e0f8544d0c81aebcfcd8be982b1021d6881c690
import ast import networkx as nx import os import pandas as pd import numpy as np MASK_TOKEN='_mask_' class OGB_ASTWalker(ast.NodeVisitor): def __init__(self): self.node_id = 0 self.stack = [] self.graph = nx.Graph() self.nodes = {} def generic_visit(self, node): node_...
snap-stanford/ogb
examples/graphproppred/code2/py2graph.py
Python
mit
5,537
[ "VisIt" ]
635d5484608e415bfa5b95cecacd80c23ff1e45ca6868410013463135ed34ecf
# -*- coding: utf-8 -*- # Copyright 2014 splinter authors. All rights reserved. # Use of this source code is governed by a BSD-style # license that can be found in the LICENSE file. from __future__ import with_statement import os.path import re import time import sys import lxml.html from lxml.cssselect import CSSSe...
harish0507/GMapsScrapper
lib/splinter-0.7.2/splinter/driver/flaskclient.py
Python
mit
13,708
[ "VisIt" ]
0f782b7327fcba28296527fe947b7dc4cbe2d2479540ba53d22fa3762748a556
# -*- 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 th...
alejob/mdanalysis
package/MDAnalysis/coordinates/MMTF.py
Python
gpl-2.0
2,868
[ "MDAnalysis" ]
034e7ed33f51556e7e95c16221a25a503953bc5d2b0c17f03b1b803c94925bf6
''' PathwayGenie (c) University of Manchester 2017 PathwayGenie is licensed under the MIT License. To view a copy of this license, visit <http://opensource.org/licenses/MIT/>. @author: neilswainston ''' # pylint: disable=signature-differs # pylint: disable=too-few-public-methods # pylint: disable=too-many-arguments...
neilswainston/development-py
synbiochemdev/assembly/optimise.py
Python
mit
4,724
[ "VisIt" ]
068a93d25e0352efeb7a3dbd5b9578a62ef99603ae79f86b6d99797de531a214
from __future__ import print_function, division from sympy import factorial, sqrt, exp, S, assoc_laguerre, Float def R_nl(n, l, r, Z=1): """ Returns the Hydrogen radial wavefunction R_{nl}. n, l quantum numbers 'n' and 'l' r radial coordinate Z atomic number (1 for Hydrog...
wolfram74/numerical_methods_iserles_notes
venv/lib/python2.7/site-packages/sympy/physics/hydrogen.py
Python
mit
4,497
[ "DIRAC" ]
eb001789f4908a3b3bdb9b00c5ded02f0b5ffa2e947998beff1c1f143538cee8
#!/usr/bin/env python # encoding: utf-8 #--------- non-linear em -------------------------- import numpy as np import pylab as plt # -------- GLOBAL SCALAR DEFINITIONS ----------------------------- # ======== all definitions are in m,s,g unit system. save_folder = '_test_ato_1' n_frames = 10 x_lower = 0. x_upper = 10...
nthakkar/emclaw
maxwell_1d_source/maxwell_ato.py
Python
gpl-2.0
12,127
[ "Gaussian" ]
af5d7e9af5c8042c6c06c0aaf5e935351f213deb779405c6e2c0d06ead194733
""" This is the XROOTD StorageClass """ __RCSID__ = "$Id$" from DIRAC import gLogger, S_OK, S_ERROR from DIRAC.Resources.Utilities.Utils import checkArgumentFormat from DIRAC.Resources.Storage.StorageBase import StorageBase from DIRAC.Core.Utilities.Pfn ...
sposs/DIRAC
Resources/Storage/XROOTStorage.py
Python
gpl-3.0
60,297
[ "DIRAC" ]
a5d03f08f544e5dda23c9334429854231f2b9abb0f80b9e1b854f59cfbc2a964
import sys import numpy as np import datetime from collections import defaultdict import os # from sklearn.metrics import confusion_matrix import glob import keras from Bio import pairwise2 import _pickle as cPickle import copy from ..features.helpers import scale_clean, scale_clean_two from .helper import lrd import k...
jeammimi/deepnano5bases
src/models/generate_training_data.py
Python
mit
24,803
[ "BWA" ]
2b656d9031275a2301af1824fb4eb31d7af008bdf9917228ae741f3df58a5d70
# 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/experimental/optimize_qed_max_steps.py
Python
apache-2.0
2,813
[ "RDKit" ]
7b5658d48776d79226462b4a00c2b06792e65ae2e9e2f8151085da1d6c5a5a78
import os import pickle import random import re import sys import time import warnings import webbrowser import twitter # pip install python-twitter import gender_guesser.detector as gender # pip install gender-guesser from requests_oauthlib import OAuth1Session from unidecode import unidecode # pip install unideco...
ajdavis/twitter-gender-distribution
analyze.py
Python
apache-2.0
17,566
[ "VisIt" ]
5319ba6b5cdd1702054cd89295803cc252d7ae00f91cc217c81a74f8b31cf655
from functools import partial from typing import Callable, List, Union import tensorflow as tf from tensorflow import Tensor from tensorflow_probability.python.distributions import (NOT_REPARAMETERIZED, Distribution) from odin.backend.interpolation import linea...
imito/odin
odin/bay/vi/autoencoder/info_vae.py
Python
mit
10,029
[ "Gaussian" ]
1905ff5cdcdbf15c75a54cc15b330f1fa33a6f9bcaf5109fdbe419b8d0ff194e
# Copyright (C) 2019 The ESPResSo project # # This file is part of ESPResSo. # # ESPResSo is free software: you can redistribute it and/or modify # it under the terms of the GNU General Public License as published by # the Free Software Foundation, either version 3 of the License, or # (at your option) any later versio...
KaiSzuttor/espresso
testsuite/scripts/samples/test_lj_liquid_distribution.py
Python
gpl-3.0
995
[ "ESPResSo" ]
68c1431c6f1bbd65dc61cee1283e059dbcc55d14db653bc07915371f701781fa
from pynet.datasets.mnist import Mnist, Mnist_Blocks import pynet.layer as layer from pynet.model import * import pynet.datasets.spec as spec import pynet.datasets.mnist as mnist import pynet.datasets.i2r as i2r import pynet.datasets.recsys as recsys import pynet.datasets.preprocessor as preproc import pynet.learning_...
hycis/Pynet
hps/models/model.py
Python
apache-2.0
23,549
[ "Gaussian" ]
706a8a350d694048dacc4f93088baef9c03d78fbd5bcc2a7fd64d09d646a0c52
# -*- Mode:Python; indent-tabs-mode:nil; tab-width:4 -*- # # Copyright 2011 Carlos Abalde <carlos.abalde@gmail.com> # # This file is part of duplicity. # # Duplicity 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 Foundat...
nils-tekampe/duplicity
duplicity/backends/gdocsbackend.py
Python
gpl-2.0
8,939
[ "VisIt" ]
98bb027746d4acffffcfe2df9fa0f5fa7f644c7cd66350d37876f05665fe7ec5
""" .. _sfm-track: ================================================== Tracking with the Sparse Fascicle Model ================================================== Tracking requires a per-voxel model. Here, the model is the Sparse Fascicle Model, described in [Rokem2015]_. This model reconstructs the diffusion signal as...
villalonreina/dipy
doc/examples/sfm_tracking.py
Python
bsd-3-clause
4,942
[ "Brian" ]
383984a1991fd4ef53b513251e3dcfc9ce468c235d16d38bc7625557415b55d2
# -*- coding: utf-8 -*- # Copyright (c) 2015-2022, Exa Analytics Development Team # Distributed under the terms of the Apache License 2.0 """ Overlap computation ###################### Utilities for computing the overlap between gaussian type functions. """ import numpy as np from numba import jit, prange from .numeri...
exa-analytics/exatomic
exatomic/algorithms/overlap.py
Python
apache-2.0
9,560
[ "Gaussian" ]
20833bdcb10e82740b3e42e705ede911185d6c528db752a683f129b2a15084ce
# coding: utf-8 from __future__ import absolute_import, division, print_function, unicode_literals from builtins import range import os import re import sys import glob import shutil import argparse import itertools import numpy as np import mdtraj as md from AdaptivePELE.atomset import atomset from AdaptivePELE.freeEn...
AdaptivePELE/AdaptivePELE
AdaptivePELE/freeEnergies/extractCoords.py
Python
mit
30,818
[ "MDTraj" ]
d759a09aad8618fa0c9f450af8b1fa3a56071d3ceb29d1d84df2bcb3bd437f3f
import scipy as sp import scipy.linalg as LA import scipy.spatial.distance as spdist import warnings def v2min_image_v(dr, cell, pbc=None, shifts_out=False): """ ------ Authors: matscipy authors - https://github.com/libAtoms/matscipy ------ Apply minimum image convention to an array of distance v...
marcocaccin/LearningMetaDynamics
ignorance_field.py
Python
gpl-2.0
10,109
[ "Matscipy" ]
865ab099576c3a3681553ac09651baa52c0f6d86d5f88e00e247ce300a76b63b
#!/opt/local/bin/python2.5 #============================================================================================= # Render a replica trajectory in PyMOL #============================================================================================= #=============================================================...
jchodera/yank
examples/human-serum-albumin-explicit/render_trajectory.py
Python
lgpl-3.0
12,339
[ "Amber", "NetCDF", "PyMOL" ]
3562b84586d4f432aeef43735f87901202d787df85542ca384039fea80658575
from __future__ import (absolute_import, division, print_function) import unittest from mantid import logger # noinspection PyUnresolvedReferences from mantid.simpleapi import mtd, Abins, Scale, CompareWorkspaces, Load, DeleteWorkspace from AbinsModules import AbinsConstants, AbinsTestHelpers import numpy as np def o...
wdzhou/mantid
Framework/PythonInterface/test/python/plugins/algorithms/AbinsBasicTest.py
Python
gpl-3.0
10,223
[ "CASTEP", "CRYSTAL" ]
83b6f597df0d2d12a893add26f013610691ec949b1b295932c8373f14819ffab
# $Id$ # # Copyright (C) 2009 Greg Landrum # All Rights Reserved # import pickle from rdkit import DataStructs, Chem from rdkit import Chem similarityMethods = { 'RDK': DataStructs.ExplicitBitVect, 'AtomPairs': DataStructs.IntSparseIntVect, 'TopologicalTorsions': DataStructs.LongSparseIntVect, 'Pharm2D': Dat...
greglandrum/rdkit
rdkit/Chem/MolDb/FingerprintUtils.py
Python
bsd-3-clause
3,728
[ "RDKit" ]
95f40d8d6423021a06330feef038fe6baac8fc5f24eabd2e38e58e09088bef2a
""" This module contains all the Data Access Objects for models which are persisted to Elasticsearch at some point in their lifecycle. Each DAO is an extension of the octopus ESDAO utility class which provides all of the ES-level heavy lifting, so these DAOs mostly just provide information on where to persist the data...
JiscPER/jper
service/dao.py
Python
apache-2.0
3,957
[ "Octopus" ]
01842fdec6354bd617a419f103d4fb33220ba04b78a9a2239b891aefee98b31b
from datetime import datetime, timezone from unittest import TestCase from opaque_keys.edx.keys import CourseKey import attr from ...data import ( CourseOutlineData, CourseSectionData, CourseLearningSequenceData, VisibilityData, CourseVisibility ) class TestCourseOutlineData(TestCase): """ Simple set of...
msegado/edx-platform
openedx/core/djangoapps/content/learning_sequences/api/tests/test_data.py
Python
agpl-3.0
5,825
[ "exciting" ]
82112223bd5afc8a9d1d109350098a801fc382bd0faecebd26f8c5464d65dc81
# -*- test-case-name: twisted.trial.test.test_tests -*- # Copyright (c) 2001-2008 Twisted Matrix Laboratories. # See LICENSE for details. """ Things likely to be used by writers of unit tests. Maintainer: Jonathan Lange """ import doctest, inspect import os, warnings, sys, tempfile, gc, types from pprint import pfo...
hortonworks/hortonworks-sandbox
desktop/core/ext-py/Twisted/twisted/trial/unittest.py
Python
apache-2.0
62,088
[ "VisIt" ]
03f9a53f2de53c32487e3c7d32b2cac72631a1d3290f0c73d00c554390a82ec3
# # Copyright 2017 Russell Smiley # # This file is part of timetools. # # timetools 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. # #...
blueskyjunkie/timeTools
timetools/synchronization/compliance/tests/testItuTG8263.py
Python
gpl-3.0
7,483
[ "Gaussian" ]
41249eb06fcf458905c0810c5eaaee80141959a05f44e63b850927f3b8bffbdc
# -*- coding: utf-8 -*- ## perform apodization of echoes using external python script ## new writing in a module like fashion in order to be able to call it from another python script def apodize_echoes(gb=None, cycle=None, echo_position=None, dead_pts=None, noDialog=False, dataset=None): """ This function appl...
jtrebosc/JTutils
TSpy/qcpmgapod.py
Python
bsd-3-clause
5,184
[ "Gaussian" ]
799e6b4cc7f4671c6c08ea997ad3cd0c22d0442d3151235fe6fd6837373a99fe
>>> from ftplib import FTP >>> ftp = FTP('ftp.ncbi.nih.gov') >>> ftp.login() '230-Anonymous access granted, restrictions apply.\n Please read the file README.ftp\n230 it was last modified on Wed Apr 7 10:18:00 2010 - 193 days ago' >>> ftp.retrlines('LIST') dr-xr-xr-x 3 ftp anonymous 4096 Sep 7 21:03 100...
abhishektiwari/ToyProjects
Python/BioRelated/ncbi_ftp.py
Python
mit
2,682
[ "BLAST" ]
38dc8c82507c094e601017ee0db15f340cc12eda5a3009e600a0bae465e8345d
#!/usr/bin/env python """ clim.py ROMS climatology utilities Written by Brian Powell on 08/15/15 Copyright (c)2017 University of Hawaii under the MIT-License. """ import seapy import numpy as np import netCDF4 def gen_bry_clim(clim_file, grid, bry, clobber=False, cdl=None): """ Taking the results ...
ocefpaf/seapy
seapy/roms/clim.py
Python
mit
2,643
[ "Brian", "NetCDF" ]
cf6592ccdda5c4af643e3dd572736e2a2ae41729bdd9ab1e98ccca95857aafd7
# Copyright Contributors to the Pyro project. # SPDX-License-Identifier: Apache-2.0 import math import warnings from math import pi import torch from torch.distributions import VonMises from torch.distributions.utils import broadcast_all, lazy_property from pyro.distributions import constraints from pyro.distributio...
uber/pyro
pyro/distributions/sine_bivariate_von_mises.py
Python
apache-2.0
11,333
[ "Gaussian" ]
68c7c4a3c4cd8c6bb5d33f5b58417b3cea1b04cbb88d74207083281426a7f56d
# coding: utf-8 # Copyright (c) Pymatgen Development Team. # Distributed under the terms of the MIT License. from __future__ import division, print_function, unicode_literals, \ absolute_import from collections import OrderedDict from io import StringIO import itertools import re import warnings import numpy as ...
johnson1228/pymatgen
pymatgen/io/lammps/data.py
Python
mit
45,831
[ "LAMMPS", "pymatgen" ]
7092db4e675761e7580ba99e34265d2bbd1d094c609d18e865008e876f5e3624
import logging handler = logging.StreamHandler() handler.setLevel(logging.INFO) handler.setFormatter(logging.Formatter('{levelname}:{name}:{msg}', style='{')) root_logger = logging.getLogger() root_logger.setLevel(logging.INFO) root_logger.addHandler(handler) from fluggo.media import process, libav, x264, matroska, f...
fluggo/Canvas
scripts/encode_x264_mkv.py
Python
gpl-3.0
3,696
[ "Brian" ]
1db5df1eb7882f4ec480610ea7b9105cd2b3596de9f46d8c17f59afdd1a9f832
#------------------------------------------------------------------------------- # . File : TeraChemOutputFile.py # . Program : MolarisTools # . Copyright : USC, Mikolaj Feliks (2015-2018) # . License : GNU GPL v3.0 (http://www.gnu.org/licenses/gpl-3.0.en.html) #------------------------------------------...
mfx9/molaris-tools
MolarisTools/Parser/TeraChemOutputFile.py
Python
gpl-3.0
7,929
[ "TeraChem" ]
37698b43e87ac6c9da3110b3f0d64ab173f3698ca9ed5409b5e44c565b6c8ca8
version_name = "OzFluxQC" version_number = "V2.9.6f" # V2.9.6f - re-write of qcio.xl_read_series() to trap different # number of rows on different worksheets # V2.9.6e - bug fix in qcts.MassmanStandard() # - fixed calculation of effective time constant # V2.9.6d - bug fix in gfSOLO_main # ...
OzFlux/OzFluxQC
scripts/cfg.py
Python
gpl-3.0
6,755
[ "NetCDF" ]
dbd932db11b1b300a33ade7632ffff1edf0e2086dc408e4da4afc527bf443a82
# Copyright (C) 2016 Collin Capano, Christopher M. Biwer, Alex Nitz # This program is free software; you can redistribute it and/or modify it # under the terms of the GNU General Public License as published by the # Free Software Foundation; either version 3 of the License, or (at your # option) any later version. # #...
stevereyes01/pycbc
pycbc/distributions/__init__.py
Python
gpl-3.0
8,568
[ "Gaussian" ]
17008eddbe4a0162e4a3e487016d3caa8eff2b65ada8276cdd0ab2b2b942e95e