X-Git-Url: http://biod.pnpi.spb.ru/gitweb/?a=blobdiff_plain;f=src%2Fgromacs%2Ftopology%2Fidef.h;h=e243e453f1b4171c8556be1acccaa7e26139503e;hb=4488887e17c2ad98c5885a8181fc460158e1476a;hp=aaac95175fa4ef19e84fe86f36abde60f042fc58;hpb=bc9ba47edc5b12b5d4324bcdbf8c5cd3cb048c3d;p=alexxy%2Fgromacs.git diff --git a/src/gromacs/topology/idef.h b/src/gromacs/topology/idef.h index aaac95175f..e243e453f1 100644 --- a/src/gromacs/topology/idef.h +++ b/src/gromacs/topology/idef.h @@ -152,12 +152,6 @@ enum { #define IS_RESTRAINT_TYPE(ifunc) (((ifunc == F_POSRES) || (ifunc == F_FBPOSRES) || (ifunc == F_DISRES) || (ifunc == F_RESTRBONDS) || (ifunc == F_DISRESVIOL) || (ifunc == F_ORIRES) || (ifunc == F_ORIRESDEV) || (ifunc == F_ANGRES) || (ifunc == F_ANGRESZ) || (ifunc == F_DIHRES))) -/* A macro for checking if ftype is an explicit pair-listed LJ or COULOMB - * interaction type: - * bonded LJ (usually 1-4), or special listed non-bonded for FEP. - */ -#define IS_LISTED_LJ_C(ftype) ((ftype) >= F_LJ14 && (ftype) <= F_LJC_PAIRS_NB) - typedef union t_iparams { /* Some parameters have A and B values for free energy calculations.