--- trunk/OOPSE/samples/alkane/butane.bass 2003/03/31 21:50:59 438 +++ trunk/OOPSE/samples/alkane/butane.bass 2003/07/15 17:11:11 612 @@ -9,7 +9,7 @@ forceField = "TraPPE_Ex"; initialConfig = "./init_butane.eor"; -forceField = "TraPPE_Ex"; +forceField = "DUFF"; targetTemp = 300.0; ensemble = NVE;