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pytopocomplexity

Overview

pytopocomplexity is an object-oriented Python library which provides generic algorithms for estimating the topographic complexity of higher dimensional energy landscapes. Additionally, some examples are included.

Requirements

pytopocomplexity requires the following:

  • future
  • numpy
  • scipy

Additionally, if you want to build the documentation and run the tests you need:

  • sphinx
  • pytest
  • pytest-cov
  • coveralls

You can get a complete development environment by installing and setting up virtualenv and virtualenvwrapper following this guide and then running the following:

$ mkvirtualenv pytopocomplexity --python=$(which python3.4)
$ pip install -r /path/to/pytopocomplexity/requirements.txt

If you want Python 2.6, 2.7, or 3.4 instead (these are the supported versions), just replace the python3.4 in the example above with python2.6, python2.7, or python3.3.

License

Copyright 2014 William Scales

Licensed under the Apache License, Version 2.0 (the "License"); you may not use this file except in compliance with the License. You may obtain a copy of the License at

http://www.apache.org/licenses/LICENSE-2.0

Unless required by applicable law or agreed to in writing, software distributed under the License is distributed on an "AS IS" BASIS, WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied. See the License for the specific language governing permissions and limitations under the License.

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