--- trunk/OOPSE-3.0/samples/shape/linear.shape 2005/04/22 21:57:16 2213 +++ trunk/OOPSE-3.0/samples/shape/linear.shape 2005/04/27 20:14:03 2214 @@ -1,27 +1,31 @@ begin ShapeInfo #name mass I_xx I_yy I_zz -linear 48.0428 86.477 86.477 0 +linear 48.0428 86.477 86.477 0 end ShapeInfo begin ContactFunctions #l m sin or cos coeff (Ang) -0 0 cos 4.32851 -2 0 cos 2.64072 -6 0 cos -0.146442 +0 0 cos 4.35343 +2 0 cos 2.60069 +4 0 cos -0.125308 +6 0 cos -0.0743899 end ContactFunctions begin RangeFunctions #l m sin or cos coeff (Ang) -0 0 cos 3.56035 -2 0 cos 0.28064 -4 0 cos 0.104529 -6 0 cos 0.285028 +0 0 cos 3.71718 +4 0 cos -0.844367 +6 0 cos 0.33514 +8 0 cos 0.395519 +10 0 cos -1.23786 +12 0 cos 0.300902 +14 0 cos 1.05381 end RangeFunctions begin StrengthFunctions #l m sin or cos coeff (kcal/mol) -0 0 cos 0.705782 -2 0 cos -0.793274 -4 0 cos 0.3388 -6 0 cos -0.045476 +0 0 cos 0.784136 +2 0 cos -0.85371 +4 0 cos 0.391814 +6 0 cos -0.102928 end StrengthFunctions