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Revisions of votca

Ana Guerrero's avatar Ana Guerrero (anag+factory) accepted request 1143680 from Christoph Junghans's avatar Christoph Junghans (cjunghans) (revision 10) 
- Drop python3-espressomd testing dependency, revert once 
  gh#espressomd/espresso#4856 is fixed.
- Dropped 1093.patch, merged upstream
  - fix links in README and doc ([gh#votca/votca#1091])
  - fix python shebang to python3 ([gh#votca/votca#1093])
  - Clean-up CI ([gh#votca/votca#1092], [gh#votca/votca#1095])
  - remove reference to old webpage ([gh#votca/votca#1094])
  - fix doc generation without pyxtp ([gh#votca/votca#1097])
  - Do not run gmx tests without libgromacs ([gh#votca/votca#1099])
  - KS-QMMM for single-particle states ([gh#votca/votca#1100])
  - Spin-orbitals from ORCA in QMMM ([gh#votca/votca#1101])
  - better unit test for DFT embedding ([gh#votca/votca#1102])
- Update to 2024
Richard Brown's avatar Richard Brown (RBrownFactory) accepted request 991629 from Christoph Junghans's avatar Christoph Junghans (cjunghans) (revision 3) 
- only use python3-epressomd for testing on x86_64
Dominique Leuenberger's avatar Dominique Leuenberger (dimstar_suse) accepted request 941551 from Christoph Junghans's avatar Christoph Junghans (cjunghans) (revision 1) 
Merge votca-* into one package for more features and better testing.
Displaying all 10 revisions
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