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MD-Studio / MDStudio_structures

Structure based cheminformatics tools service for MDStudio
Apache License 2.0
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Segmentation fault with pybel based PDB format conversion #8

Open marcvdijk opened 6 years ago

marcvdijk commented 6 years ago

At least certain PDB file formats result in a segmentation fault:

entry_point_lie_structures.sh: line 5: 8 Segmentation fault python -u -m lie_structures

with an attempt to convert it to mol2 using the default pybel toolkit