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meta.yaml
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meta.yaml
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{% set name = "buildh" %}
{% set version = "1.6.1" %}
package:
name: "{{ name|lower }}"
version: "{{ version }}"
source:
url: "https://pypi.io/packages/source/{{ name[0] }}/{{ name }}/{{ name }}-{{ version }}.tar.gz"
sha256: 3cde8aacf807813d4be3e7f83142f24670a8af6334f0187fb6193b9ff30c5a5d
build:
number: 0
script: "{{ PYTHON }} -m pip install . -vv --no-deps"
entry_points:
- buildH = buildh.UI:entry_point
noarch: python
requirements:
host:
- python >=3.6
- pip
run:
- python >=3.6
- numpy
- pandas
- MDAnalysis
- numba
test:
imports:
- buildh
commands:
- buildH --help
about:
home: https://github.com/patrickfuchs/buildH
license: BSD 3-Clause
license_family: BSD
license_file: "LICENSE.txt"
summary: "Build hydrogen atoms from a united-atom MD of lipids and calculate the order parameter."
doc_url: https://buildh.readthedocs.io/
extra:
recipe-maintainers:
- patrickfuchs
- HubLot
- pierrepo