python312Packages.meeko: fix build
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@@ -2,7 +2,7 @@
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lib,
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buildPythonPackage,
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fetchFromGitHub,
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fetchpatch,
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gemmi,
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numpy,
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pytestCheckHook,
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pythonOlder,
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@@ -24,22 +24,9 @@ buildPythonPackage rec {
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hash = "sha256-ViIBiczwxTwraYn8UnFAZFCFT28v3WEYm04W2YpU/4g=";
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};
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patches = [
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# https://github.com/forlilab/Meeko/issues/60
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(fetchpatch {
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name = "fix-unknown-sidechains.patch";
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url = "https://github.com/forlilab/Meeko/commit/28c9fbfe3b778aa1bd5e8d7e4f3e6edf44633a0c.patch";
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hash = "sha256-EJbLnbKTTOsTxKtLiU7Af07yjfY63ungGUHbGvrm0AU=";
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})
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(fetchpatch {
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name = "add-test-data.patch";
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url = "https://github.com/forlilab/Meeko/commit/57b52e3afffb82685cdd1ef1bf6820d55924b97a.patch";
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hash = "sha256-nLnyIjT68iaY3lAEbH9EJ5jZflhxABBwDqw8kaRKf3k=";
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})
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];
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propagatedBuildInputs = [
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# setup.py only requires numpy but others are needed at runtime
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gemmi
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numpy
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rdkit
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scipy
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