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  1. Jul 13, 2019
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  4. Feb 27, 2019
    • 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
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    • Gareth Tribello's avatar
      Ran astyle · 1f6afac2
      Gareth Tribello authored
      1f6afac2
    • Gareth Tribello's avatar
      Fix to bug in multicolvars + filters · 2052d35a
      Gareth Tribello authored
      This fixes a problem in the way atoms are setup for calculations where you take an input
      from a multicolvar filter as input to a new multicolvar if SPECIESA and SPECIESB are used.
      For instance you might be calculating Q6 for those atoms that have a coordination number
      greater than 4
      2052d35a
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