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pymolfile
Commit 1be60c10 authored by Berk Onat's avatar Berk Onat
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One Cmake call for all

parent 086f4be1
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build/lib.macosx-10.12-x86_64-3.6/pymolfile/__init__.py deleted 100644 → 0
View file @ 086f4be1
from __future__ import absolute_import
import warnings
try:
from .molfile import libpymolfile
except ImportError:
warnings.warn("libpymolfile package not available, pymolfile does not work without its library!")
from . import plugin_list
from . import pymolfile
__all__ = [ "pymolfile" ]
from .pymolfile import OpenMolfile, list_plugins
build/lib.macosx-10.12-x86_64-3.6/pymolfile/molfile/__init__.py deleted 100644 → 0
View file @ 086f4be1
# Stand-alone python bindings for libpymolfile
# Copyright (c) 2017 Berk Onat <b.onat@warwick.ac.uk>
# Published under the UIUC OpenSource LICENSE
"""libpymolfile library.
"""
build/lib.macosx-10.12-x86_64-3.6/pymolfile/molfile/libpymolfile.py deleted 100644 → 0
View file @ 086f4be1
# This file was automatically generated by SWIG (http://www.swig.org).
# Version 3.0.12
#
# Do not make changes to this file unless you know what you are doing--modify
# the SWIG interface file instead.
"""
:Author: Berk Onat <b.onat@warwick.ac.uk>
:Year: 2017
:Licence: UIUC LICENSE
"""
from sys import version_info as _swig_python_version_info
if _swig_python_version_info >= (2, 7, 0):
def swig_import_helper():
import importlib
pkg = __name__.rpartition('.')[0]
mname = '.'.join((pkg, '_libpymolfile')).lstrip('.')
try:
return importlib.import_module(mname)
except ImportError:
return importlib.import_module('_libpymolfile')
_libpymolfile = swig_import_helper()
del swig_import_helper
elif _swig_python_version_info >= (2, 6, 0):
def swig_import_helper():
from os.path import dirname
import imp
fp = None
try:
fp, pathname, description = imp.find_module('_libpymolfile', [dirname(__file__)])
except ImportError:
import _libpymolfile
return _libpymolfile
try:
_mod = imp.load_module('_libpymolfile', fp, pathname, description)
finally:
if fp is not None:
fp.close()
return _mod
_libpymolfile = swig_import_helper()
del swig_import_helper
else:
import _libpymolfile
del _swig_python_version_info
try:
_swig_property = property
except NameError:
pass # Python < 2.2 doesn't have 'property'.
try:
import builtins as __builtin__
except ImportError:
import __builtin__
def _swig_setattr_nondynamic(self, class_type, name, value, static=1):
if (name == "thisown"):
return self.this.own(value)
if (name == "this"):
if type(value).__name__ == 'SwigPyObject':
self.__dict__[name] = value
return
method = class_type.__swig_setmethods__.get(name, None)
if method:
return method(self, value)
if (not static):
if _newclass:
object.__setattr__(self, name, value)
else:
self.__dict__[name] = value
else:
raise AttributeError("You cannot add attributes to %s" % self)
def _swig_setattr(self, class_type, name, value):
return _swig_setattr_nondynamic(self, class_type, name, value, 0)
def _swig_getattr(self, class_type, name):
if (name == "thisown"):
return self.this.own()
method = class_type.__swig_getmethods__.get(name, None)
if method:
return method(self)
raise AttributeError("'%s' object has no attribute '%s'" % (class_type.__name__, name))
def _swig_repr(self):
try:
strthis = "proxy of " + self.this.__repr__()
except __builtin__.Exception:
strthis = ""
return "<%s.%s; %s >" % (self.__class__.__module__, self.__class__.__name__, strthis,)
try:
_object = object
_newclass = 1
except __builtin__.Exception:
class _object:
pass
_newclass = 0
def molfile_plugin_list(maxsize: 'int') -> "PyObject *":
"""molfile_plugin_list(maxsize) -> PyObject *"""
return _libpymolfile.molfile_plugin_list(maxsize)
def molfile_init() -> "int":
"""molfile_init() -> int"""
return _libpymolfile.molfile_init()
def molfile_finish() -> "int":
"""molfile_finish() -> int"""
return _libpymolfile.molfile_finish()
def get_plugin(molcapsule: 'PyObject *', plug_no: 'int') -> "PyObject *":
"""get_plugin(molcapsule, plug_no) -> PyObject *"""
return _libpymolfile.get_plugin(molcapsule, plug_no)
def molfile_plugin_info(molcapsule: 'PyObject *', plugin_no: 'int') -> "PyObject *":
"""molfile_plugin_info(molcapsule, plugin_no) -> PyObject *"""
return _libpymolfile.molfile_plugin_info(molcapsule, plugin_no)
def open_file_read(molcapsule: 'PyObject *', fname: 'char *', ftype: 'char *', natoms: 'int') -> "PyObject *":
"""open_file_read(molcapsule, fname, ftype, natoms) -> PyObject *"""
return _libpymolfile.open_file_read(molcapsule, fname, ftype, natoms)
def close_file_read(molpack: 'PyObject *') -> "PyObject *":
"""close_file_read(molpack) -> PyObject *"""
return _libpymolfile.close_file_read(molpack)
def read_fill_structure(molpack: 'PyObject *', prototype: 'PyObject *') -> "PyObject *":
"""read_fill_structure(molpack, prototype) -> PyObject *"""
return _libpymolfile.read_fill_structure(molpack, prototype)
def read_fill_bonds(molpack: 'PyObject *') -> "PyObject *":
"""read_fill_bonds(molpack) -> PyObject *"""
return _libpymolfile.read_fill_bonds(molpack)
def read_fill_angles(molpack: 'PyObject *') -> "PyObject *":
"""read_fill_angles(molpack) -> PyObject *"""
return _libpymolfile.read_fill_angles(molpack)
def read_fill_next_timestep(molpack: 'PyObject *') -> "PyObject *":
"""read_fill_next_timestep(molpack) -> PyObject *"""
return _libpymolfile.read_fill_next_timestep(molpack)
def are_plugins_same(molpack_a: 'PyObject *', molpack_b: 'PyObject *') -> "PyObject *":
"""are_plugins_same(molpack_a, molpack_b) -> PyObject *"""
return _libpymolfile.are_plugins_same(molpack_a, molpack_b)
def are_filehandles_same(molpack_a: 'PyObject *', molpack_b: 'PyObject *') -> "PyObject *":
"""are_filehandles_same(molpack_a, molpack_b) -> PyObject *"""
return _libpymolfile.are_filehandles_same(molpack_a, molpack_b)
# This file is compatible with both classic and new-style classes.
build/lib.macosx-10.12-x86_64-3.6/pymolfile/plugin_list.py deleted 100644 → 0
View file @ 086f4be1
import warnings
import sys
from .molfile import libpymolfile
try:
from .molfile import libpymolfile
except ImportError:
warnings.warn("libpymolfile package not available, pymolfile does not work without its library!")
MAX_NUM_PLUGINS = 200
C_MOLFILE_PLUGINS = libpymolfile.molfile_plugin_list(MAX_NUM_PLUGINS)
def byte_str_decode(data, dectype=None):