--- trunk/OOPSE/libmdtools/Thermo.hpp	2003/09/09 20:35:25	755
+++ trunk/OOPSE/libmdtools/Thermo.hpp	2004/04/20 16:56:40	1127
@@ -30,7 +30,6 @@ class Thermo{ (public)
                                                 // tensor in 
                                                 // amu*fs^-2*Ang^-1
   double getVolume();   // gives the volume in Ang^3 
-  double getEnthalpy(); // gives the enthalpy in kcal/mol
 
   int getNDF();    // get the number of degrees of freedom in the system
   int getNDFraw(); // get the number of raw degrees of freedom in the system
@@ -39,6 +38,8 @@ class Thermo{ (public)
   void velocitize(); // set the temperature to the target temp in SimInfo
                      // NOTE: srand48 should be seeded before calling.
   void getCOMVel(double vdrift[3]);
+  void getCOM(double COM[3]);
+  void removeCOMdrift();
 
 private:
   SimInfo* info;