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  1. Jun 24, 2019
  2. Jun 21, 2019
  3. May 27, 2019
  4. May 25, 2019
  5. May 20, 2019
  6. May 14, 2019
    • Giovanni Bussi's avatar
      small fix · 11bbf717
      Giovanni Bussi authored
      should be not important. In particular, when invsigma was <10-12
      sigma was set as equal to invsigma. Now it is set to zero,
      which I think is the expected behavior.
      11bbf717
  7. May 07, 2019
  8. May 01, 2019
    • Giovanni Bussi's avatar
      fix #469 · fb681c9a
      Giovanni Bussi authored
      python module should always be called `plumed`, irrespectively of
      prefix/suffix. Notice that if installing multiple plumed versions
      side by side different python modules will anyway end up in different
      directories (`lib/program_name`).
      fb681c9a
  9. Apr 30, 2019
  10. Apr 24, 2019
  11. Apr 16, 2019
  12. Apr 11, 2019
  13. Apr 09, 2019
  14. Apr 05, 2019
  15. Apr 03, 2019
    • carlocamilloni's avatar
      DRIVER: new --parse-only flag · 670b826d
      carlocamilloni authored
      this allows parsing the plumed input file by setting the number of atoms without the need of reading a trajectory file
      DRIVER does plumed initialisation and then stops
      
      @all this is meant for the plumed-nest, please have a look and comment
      670b826d
  16. Apr 02, 2019
  17. Mar 29, 2019
  18. Mar 19, 2019
  19. Mar 15, 2019
  20. Feb 27, 2019
    • Giovanni Bussi's avatar
      Removed duplicated keywords · fce7e1bd
      Giovanni Bussi authored
      see 8ed9697a
      fce7e1bd
    • Giovanni Bussi's avatar
      Removed duplicates keywords · 8ed9697a
      Giovanni Bussi authored
      Can be found with the following python snippet
      
      import re
      plumedDictionary={}
      with open("/opt/local/lib/plumed/vim/syntax/plumed.vim") as fin:
          for line in fin:
              if re.match("^let b:plumedDictionary\[.*$",line):
                  line=re.sub("^let b:","",line)
                  exec(line,{'__builtins__': None},{'plumedDictionary':plumedDictionary})
      for key in plumedDictionary.keys():
          diction={}
          for opt in plumedDictionary[key]:
              if(opt['word'] in diction):
                  print(key,opt['word'])
              diction[opt['word']]=1
      8ed9697a
  21. Feb 25, 2019
  22. Feb 22, 2019
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