pyrox.dev
python3Packages.rdkit: 2022.09.1 -> 2022.09.5 (#224600)
authored by
OTABI Tomoya
and committed by
GitHub
83a39a0a
3a6205d9
+5
-3
pkgs/development/python-modules/rdkit/default.nix
+5
-3
pkgs/development/python-modules/rdkit/default.nix
···
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in
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buildPythonPackage rec {
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pname = "rdkit";
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-
version = "2022.09.1";
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format = "other";
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src =
···
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owner = pname;
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repo = pname;
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rev = "Release_${versionTag}";
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-
hash = "sha256-AaawjCv3/ShByOKU0c37/hjuyfD7NhFC8UngDoG7C0s=";
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};
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unpackPhase = ''
···
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find . -type d -exec chmod +w {} +
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mkdir External/AvalonTools/avalon
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-
ln -s ${external.avalon}/* External/AvalonTools/avalon
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mkdir External/YAeHMOP/yaehmop
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ln -s ${external.yaehmop}/* External/YAeHMOP/yaehmop
···
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in
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buildPythonPackage rec {
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pname = "rdkit";
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+
version = "2022.09.5";
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format = "other";
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src =
···
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owner = pname;
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repo = pname;
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rev = "Release_${versionTag}";
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+
hash = "sha256-zsiH4gNCAeXDLjHhDsKwZMkTvVCWG9LwAaEKNOuqV2Q=";
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};
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unpackPhase = ''
···
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find . -type d -exec chmod +w {} +
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mkdir External/AvalonTools/avalon
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+
# In buildPhase, CMake patches the file in this directory
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+
# see https://github.com/rdkit/rdkit/pull/5928
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+
cp -r ${external.avalon}/* External/AvalonTools/avalon
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mkdir External/YAeHMOP/yaehmop
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ln -s ${external.yaehmop}/* External/YAeHMOP/yaehmop