<commit_before>{% set name = "ForceBalance" %}
{% set version = "1.7.3" %}
{% set sha256 = "d662e48862c861af6b0bc1c917ef90c65a51ad7102368b0c3945c9aff3450621" %}

package:
  name: {{ name|lower }}
  version: {{ version }}

source:
  url: https://github.com/leeping/{{ name }}/archive/v{{ version }}.tar.gz
  sha256: {{ sha256 }}

build:
  noarch: python
  number: 0
  script: "{{ PYTHON }} -m pip install . -vv"
  skip: True # [win]

requirements:
  host:
    - python
    - setuptools
    - pip
  run:
    - {{ pin_compatible('numpy', lower_bound='1.14') }}
    - scipy
    - setuptools
    - pymbar
    - future
    - networkx
    - lxml
    - zlib
    - swig

test:
  imports:
    - pytest
    - forcebalance
  requires:
    - pytest
  commands:
    - py.test --pyargs forcebalance

about:
  home: http://github.com/leeping/forcebalance/
  license: BSD 2.0
  license_family: BSD
  license_file: LICENSE
  summary: "Automated force field optimization."

  doc_url: https://leeping.github.io/forcebalance/doc/html/
  dev_url: http://github.com/leeping/forcebalance/

extra:
  recipe-maintainers:
    - leeping
    - mattwthompson
    - j-wags
    - dotsdl
<commit_msg>Lint: Update license identifier and drop selector<commit_after>{% set name = "ForceBalance" %}
{% set version = "1.7.3" %}
{% set sha256 = "d662e48862c861af6b0bc1c917ef90c65a51ad7102368b0c3945c9aff3450621" %}

package:
  name: {{ name|lower }}
  version: {{ version }}

source:
  url: https://github.com/leeping/{{ name }}/archive/v{{ version }}.tar.gz
  sha256: {{ sha256 }}

build:
  noarch: python
  number: 0
  script: "{{ PYTHON }} -m pip install . -vv"

requirements:
  host:
    - python
    - setuptools
    - pip
  run:
    - {{ pin_compatible('numpy', lower_bound='1.14') }}
    - scipy
    - setuptools
    - pymbar
    - future
    - networkx
    - lxml
    - zlib
    - swig

test:
  imports:
    - pytest
    - forcebalance
  requires:
    - pytest
  commands:
    - py.test --pyargs forcebalance

about:
  home: http://github.com/leeping/forcebalance/
  license: BSD-3-Clause
  license_family: BSD
  license_file: LICENSE
  summary: "Automated force field optimization."

  doc_url: https://leeping.github.io/forcebalance/doc/html/
  dev_url: http://github.com/leeping/forcebalance/

extra:
  recipe-maintainers:
    - leeping
    - mattwthompson
    - j-wags
    - dotsdl

{'fraction_non_alphanumeric': 0.1366723259762309, 'fraction_numerical': 0.05135823429541596, 'mean_word_length': 2.665629860031104, 'pattern_counts': {'":': 0, '<': 3, '<?xml version=': 0, '>': 3, 'https://': 4, 'lorem ipsum': 0, 'www.': 0, 'xml': 2}, 'pii_count': 0, 'substrings_counts': 0, 'word_list_counts': {'cursed_substrings.json': 0, 'profanity_word_list.json': 0, 'sexual_word_list.json': 0, 'zh_pornsignals.json': 0}}
{'dir': 'git-commits-cleaned', 'id': '5947228', 'n_tokens_mistral': 956, 'n_tokens_neox': 891, 'n_words': 180}