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Avoid rdkit upgrade
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autodock/__init__.py

Lines changed: 2 additions & 2 deletions
Original file line numberDiff line numberDiff line change
@@ -236,8 +236,8 @@ def addRingtailPackage(cls, env, default=True):
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installer.addCommand(f'{cls.getEnvActivationCommand(RDKIT_DIC)} && '
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f'conda install ringtail={RINGTAIL_DIC["version"]} pymol-open-source -y',
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'RINGTAIL_INSTALLED'). \
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addCommand(f'{cls.getEnvActivationCommand(RDKIT_DIC)} && pip install {MEEKO_DIC["name"]}=={MEEKO_DIC["version"]}',
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'MEEKO_INSTALLED'). \
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addCommand(f'{cls.getEnvActivationCommand(RDKIT_DIC)} && pip install --no-deps '
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f'{MEEKO_DIC["name"]}=={MEEKO_DIC["version"]}', 'MEEKO_INSTALLED'). \
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addPackage(env, dependencies=['conda'], default=default)
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@classmethod

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