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Published February 6, 2020 | Version 0.9.3
Software Open

chemfiles/chemfiles: Version 0.9.3

Creators

  • 1. EPFL
  • 2. National University of Quilmes
  • 3. Heinrich-Heine-Universität Düsseldorf

Description

This is a small bugfix release of chemfiles, all users are encouraged to update.

  • Fix a bug in the PDB format where no atomic name/type was read from short ATOM/HETATM records.
  • Fix a few bugs related to UnitCell Matrix and infinite UnitCell construction
  • Fix compilation of the code with older CMake (2.8.12)

Files

chemfiles/chemfiles-0.9.3.zip

Files (6.2 MB)

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md5:221d62e2ec00491e449a9a95ea0169cf
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Additional details

Related works

Is supplement to
https://github.com/chemfiles/chemfiles/tree/0.9.3 (URL)