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Created with Raphaël 2.2.015Feb141312765432131Jan2925242322211712111098543231Dec30222120181398753130Nov2928272322211615149831Oct242322Sep2120191186429Aug2824231817161511109831Jul2726252422211918141210765329Jun282320191512652131May302625242316121110954221Apr2019629Mar28242317161310976532128Feb222120171615109876131Jan3027262524232220191817161353123Dec222130Nov292818171615832131Oct2725427Sep252220compare-structures: docu updateMerge branch 'ci_testing' into developCI: add compound libRevert "CI: test a CI failure"CI: test a CI failureCI: download compounds after first buildCI: use make as documented in the wikiCI: try to download and build a compound libCI: try to link the compound lib differentlyCI: try to use the group compound libtest: fix check_resname testUpdate Singularity to working Jupyter.chain mapping: replace GlobalAlign with SemiGlobalAlign in chain alignmentMerge branch 'master' into developMerge branch 'release-2.7.0'2.7.02.7.0improve error message when invalid CompoundLib gets loadedmmcif writer: introduce _atom_site.pdbx_PDB_model_numUpdate version to 2.7.0update external USalign codeavoid deprecated use of std::iterator (deprecated with c++ 17)omf: bugfixtypodoc: add to changelog for 2.7.0refactor: save only the exception messagerefactor: make error messages more consistent in actionsrefactor: make error messages more pythonic and consistentchain mapping: reduce default for min_pep_length from 10 to 6update CHANGELOGmmcir writer: bugfixmmcif writer: docu updatemmcif writer: avoid hardcoded monomer id for water chainmmcif writer: ensure that all hetero residues are written in chem compmmcif writer: enable heterogeneities in predefined MMCifWriterEntitymmcif writer: refactor providing MMCifWriterEntityfix: clean error message for missing compound libTesting reading star formatted files with leading whitespacesAllow whitespaces in front of Star-formated linesmmcif reader: bugfixcleanup: remove unnecessary checkmmcif writer: re-enable Start counting entities at 1 in the mmCIF writer