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meta.yaml
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meta.yaml
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# For conda build
package:
name: pydqed
version: "0" # set by build.sh which gets it from the module
source:
path: .
build:
number: {{ environ.get('GIT_DESCRIBE_NUMBER', 0) }} # number of commits since last git tag (which should be last change to __version__)
requirements:
build:
- gcc # [unix]
- gcc ==4.8.2 # [linux32]
- python 2.7* # for compatibility with RDKit
- setuptools
- cython ==0.21
- numpy
run:
- libgcc # [unix]
- python 2.7* # for compatibility with RDKit
- numpy
test:
files:
- test.py
imports:
- pydqed
commands:
- python test.py
about:
home: http://github.com/ReactionMechanismGenerator/PyDQED
license: MIT
summary: "A Python wrapper to the DQED bounded constrained nonlinear optimization code."