Add value_ref and value to pull_coord_t

[alexxy/gromacs.git] / src / gromacs / legacyheaders / types / inputrec.h

diff --git a/src/gromacs/legacyheaders/types/inputrec.h b/src/gromacs/legacyheaders/types/inputrec.h
index 01b5451b7b85bba4297cb0ff0a9bbe482fcff938..95cfc402cd00bb5cc3177bea6bfa1dc5c0218e38 100644 (file)
--- a/src/gromacs/legacyheaders/types/inputrec.h
+++ b/src/gromacs/legacyheaders/types/inputrec.h
@@ -139,6 +139,8 @@ typedef struct {
     real        kB;         /* force constant for state B */
 
     /* Variables not present in mdp, but used at run time */
+    double      value_ref;  /* The reference value, usually init+rate*t */
+    double      value;      /* The current value of the coordinate */
     dvec        dr;         /* The distance from the reference group */
     double      vec_len;    /* Length of vec for direction-relative */
     dvec        ffrad;      /* conversion factor from vec to radial force */