Merge pull request #584 from lilleswing/lazy-load-karl

- if [[ "$TRAVIS_PYTHON_VERSION" == "2.7" ]]; then wget https://repo.continuum.io/archive/Anaconda2-4.3.0-Linux-x86_64.sh

  -O anaconda.sh; else wget https://repo.continuum.io/archive/Anaconda3-4.3.0-Linux-x86_64.sh

  -O anaconda.sh; fi

- export python_version=$TRAVIS_PYTHON_VERSION

- bash anaconda.sh -b -p $HOME/anaconda

- export PATH="$HOME/anaconda/bin:$PATH"

- hash -r

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"""

Tests for binding pocket detection. 

"""

from __future__ import print_function

from __future__ import division

from __future__ import print_function

from __future__ import unicode_literals

__author__ = "Bharath Ramsundar"

import sys

from deepchem.utils.dependencies import mdtraj as md

import unittest

import tempfile

import os

import shutil

import numpy as np

import deepchem as dc

from nose.tools import nottest

from deepchem.utils import rdkit_util

    assert len(pockets) < len(all_pockets)

  @nottest

  def test_rf_convex_find_pockets(self):

    """Test that filter with pre-trained RF models works."""

    if sys.version_info >= (3, 0):

import unittest

import os

from nose.plugins.attrib import attr

from nose.tools import nottest

import sys

import deepchem as dc

    # Check returned files exist

    assert score.shape == (1,)

  @nottest

  def test_pocket_vina_grid_rf_docker_dock(self):

    """Test that VinaGridRFDocker can dock."""

    if sys.version_info >= (3, 0):

  """

  def __init__(self, tasks, model_builder, model_dir=None, verbose=True):

    super().__init__(self, model_dir=model_dir, verbose=verbose)

    super(SingletaskToMultitask, self).__init__(

        self, model_dir=model_dir, verbose=verbose)

    self.tasks = tasks

    self.task_model_dirs = {}

    self.model_builder = model_builder