dpdata

recipes/dpdata/meta.yaml

@@ -0,0 +1,43 @@
+{% set name = "dpdata" %}
+{% set version = "0.1.0" %}
+
+package:
+  name: {{ name|lower }}
+  version: {{ version }}
+
+source:
+  url: https://pypi.io/packages/source/{{ name[0] }}/{{ name }}/{{ name }}-{{ version }}.tar.gz
+  sha256: 35e94002256d8cc98f5c4109dbd645181117fb5d9489812d934d0c8757cdfd7f
+  patches:
+    - version.diff
+
+build:
+  number: 0
+  noarch: python
+  script: "{{ PYTHON }} -m pip install . --no-deps -vv"
+
+requirements:
+  host:
+    - python >=3.5
+    - pip
+    - numpy
+  run:
+    - python >=3.5
+    - {{ pin_compatible('numpy') }}
+    - monty
+
+test:
+  imports:
+    - dpdata
+
+about:
+  home: https://github.com/deepmodeling/dpdata
+  license: LGPL-3.0
+  license_family: LGPL
+  summary: 'Manipulating DeePMD-kit, VASP and LAMMPS data formats'
+  doc_url: https://github.com/deepmodeling/dpdata
+  dev_url: https://github.com/deepmodeling/dpdata
+
+extra:
+  recipe-maintainers:
+    - njzjz

recipes/dpdata/version.diff

@@ -0,0 +1,14 @@
+diff --git a/setup.py b/setup.py
+index 800da34..014bef6 100644
+--- a/setup.py
++++ b/setup.py
+@@ -17,8 +17,7 @@
+ setuptools.setup(
+     name="dpdata",
+     version_format='{tag}.dev{commitcount}+{gitsha}',
+-    setup_requires=['setuptools-git-version'],
+-    # version="0.0.2",
++    version="0.1.0",
+     author="Han Wang",
+     author_email="wang_han@iapcm.ac.cn",
+     description="Manipulating DeePMD-kit, VASP and LAMMPS data formats",