| # | Line 129 | Line 129 | class SimInfo{ (public) | |
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| 129 | ||
| 130 | int seed; //seed for random number generator | |
| 131 | ||
| 132 | < | int useThermInt; // whether or not we use thermodynamic integration |
| 132 | > | int useSolidThermInt; // is solid-state thermodynamic integration being used |
| 133 | > | int useLiquidThermInt; // is liquid thermodynamic integration being used |
| 134 | double thermIntLambda; // lambda for TI | |
| 135 | double thermIntK; // power of lambda for TI | |
| 136 | double vRaw; // unperturbed potential for TI | |
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