add placeholders to include files for error messges
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@ -59,6 +59,30 @@ class PairPython : public Pair {
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/* ERROR/WARNING messages:
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E: Could not find 'compute_force' method'
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UNDOCUMENTED
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E: Python 'compute_force' is not callable
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UNDOCUMENTED
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E: Could not find 'compute_energy' method'
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UNDOCUMENTED
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E: Python 'compute_energy' is not callable
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UNDOCUMENTED
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E: Could not create tuple for 'compute' function arguments
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UNDOCUMENTED
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E: Calling 'compute_force' function failed
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UNDOCUMENTED
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E: Illegal ... command
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Self-explanatory. Check the input script syntax and compare to the
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@ -69,7 +93,59 @@ E: Incorrect args for pair coefficients
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Self-explanatory. Check the input script or data file.
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E: Pair cutoff < Respa interior cutoff
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E: Python pair style requires fully qualified class name
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UNDOCUMENTED
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E: Loading python pair style module failure
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UNDOCUMENTED
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E: Could not find pair style class in module'
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UNDOCUMENTED
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E: Could not instantiate instance of pair style class'
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UNDOCUMENTED
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E: Could not find 'check_units' method'
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UNDOCUMENTED
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E: Python 'check_units' is not callable
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UNDOCUMENTED
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E: Could not create tuple for 'check_units' function arguments
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UNDOCUMENTED
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E: Calling 'check_units' function failed
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UNDOCUMENTED
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E: Could not find 'map_coeff' method'
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UNDOCUMENTED
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E: Python 'map_coeff' is not callable
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UNDOCUMENTED
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E: Could not create tuple for 'map_coeff' function arguments
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UNDOCUMENTED
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E: Calling 'map_coeff' function failed
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UNDOCUMENTED
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E: Calling 'compute_energy' function failed
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UNDOCUMENTED
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U: Pair cutoff < Respa interior cutoff
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One or more pairwise cutoffs are too short to use with the specified
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rRESPA cutoffs.
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