Project Openings

[#743] ccp4-7.0: coot does not understand cif-file from acedrg

Date:
2015-11-06 01:35

Priority:
5

State:
Open

Submitted by:
Andrey Lebedev (andrey)

Assigned to:
Fei Long (flong)

Summary:
ccp4-7.0: coot does not understand cif-file from acedrg

Detailed description
ccp4-7.0 alpha, acedrg output cif-file: - coot does not understand this file (Files > Import cif-dictionary) - coot will understand the cif-file if you remove lines at the end of the file, just after definition of planes (these lines include smile string)
ccp4-7.0 alpha, acedrg output cif-file: - coot does not understand this file (Files > Import cif-dictionary) - coot will understand the cif-file if you remove lines at the end of the file, just after definition of planes (these lines include smile string)

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Message
Date: 2015-11-10 01:52 Sender: Fei Long The Bug fixed by adding the space between columns "_pdbx_chem_comp_descriptor.program" and "_pdbx_chem_comp_descriptor.program_version" in the last section of the output cif-dictionary. A new version is committed. Fei Long

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