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#ifdef __C |
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#ifndef __FINTERACTIONMAP |
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#define __FINTERACTIONMAP |
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|
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#define LJ_PAIR 1 |
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#define ELECTROSTATIC_PAIR 2 |
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#define STICKY_PAIR 4 |
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#define STICKYPOWER_PAIR 8 |
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#define GB_PAIR 16 |
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#define GB_LJ 32 |
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#define EAM_PAIR 64 |
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#define SHAPE_PAIR 128 |
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#define SHAPE_LJ 256 |
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#define FLARB_PAIR 512 |
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#define POT_ARRAY_SIZE 11 |
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#define LJ_POT 1 |
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#define ELECTROSTATIC_POT 2 |
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#define STICKY_POT 3 |
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#define STICKYPOWER_POT 4 |
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#define GB_POT 5 |
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#define GB_LJ_POT 6 |
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#define EAM_POT 7 |
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#define SHAPE_POT 8 |
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#define SHAPE_LJ_POT 9 |
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#define FLARB_POT 10 |
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#define RF_POT 11 |
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#endif |
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#endif /*__C*/ |
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#ifdef __FORTRAN90 |
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INTEGER, PARAMETER:: LJ_PAIR = 1 |
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INTEGER, PARAMETER:: ELECTROSTATIC_PAIR = 2 |
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INTEGER, PARAMETER:: STICKY_PAIR = 4 |
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INTEGER, PARAMETER:: STICKYPOWER_PAIR = 8 |
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INTEGER, PARAMETER:: GAYBERNE_PAIR = 16 |
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INTEGER, PARAMETER:: GAYBERNE_LJ = 32 |
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INTEGER, PARAMETER:: EAM_PAIR = 64 |
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INTEGER, PARAMETER:: SHAPE_PAIR = 128 |
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INTEGER, PARAMETER:: SHAPE_LJ = 256 |
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INTEGER, PARAMETER:: FLARB_PAIR = 512 |
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INTEGER, PARAMETER:: POT_ARRAY_SIZE = 10 |
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|
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INTEGER, PARAMETER:: LJ_POT = 1 |
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INTEGER, PARAMETER:: ELECTROSTATIC_POT = 2 |
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INTEGER, PARAMETER:: STICKY_POT = 3 |
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INTEGER, PARAMETER:: STICKYPOWER_POT = 4 |
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INTEGER, PARAMETER:: GAYBERNE_POT = 5 |
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INTEGER, PARAMETER:: GAYBERNE_LJ_POT = 6 |
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INTEGER, PARAMETER:: EAM_POT = 7 |
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INTEGER, PARAMETER:: SHAPE_POT = 8 |
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INTEGER, PARAMETER:: SHAPE_LJ_POT = 9 |
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INTEGER, PARAMETER:: FLARB_POT = 10 |
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INTEGER, PARAMETER:: RF_POT = 11 |
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#endif |
