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  1. Mar 09, 2017
    • Marco's avatar
      Applied suggested modifications: citation and virial. · 032ccd57
      Marco authored
      * Citation fixed as suggested
      * Added PBC-friendly virial contributions: compared with the numerical derivatives
        for a configuration and the same with a dimer shifted by the lattice vector on one of its components.
      032ccd57
  2. Mar 03, 2017
    • Marco's avatar
      I thought that maybe not explicitly giving an output format in · 563699b9
      Marco authored
      the regtext might produce different results on other architectures so I added
      a numeric format keyword to the plumed.dat file of both regtexts.
      Also the test .pdb configurations are improved, being now taken from a trajectory rather than
      a starting configuration.
      563699b9
  3. Mar 02, 2017
  4. Feb 28, 2017
  5. Feb 27, 2017
  6. Feb 26, 2017
  7. Feb 24, 2017
  8. Feb 23, 2017
  9. Feb 22, 2017
  10. Feb 21, 2017
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