| # | Line 8 | Line 8 | typedef struct{ | |
|---|---|---|
| 8 | typedef struct{ | |
| 9 | int DistanceMixingRule; | |
| 10 | int EnergyMixingRule; | |
| 11 | < | double vdw14scale; |
| 12 | < | double electrostatic14scale; |
| 11 | > | RealType vdw14scale; |
| 12 | > | RealType electrostatic14scale; |
| 13 | } ForceOptions; | |
| 14 | ||
| 15 | ||
| # | Line 21 | Line 21 | typedef struct{ | |
| 21 | INTEGER, PARAMETER:: GEOMETRIC_MIXING_RULE = 1 | |
| 22 | INTEGER, PARAMETER:: ARITHMETIC_MIXING_RULE = 2 | |
| 23 | ||
| 24 | < | type,public :: ForceOptions |
| 24 | > | type :: ForceOptions |
| 25 | SEQUENCE | |
| 26 | integer :: DistanceMixingRule | |
| 27 | integer :: EnergyMixingRule | |
| – | Removed lines |
| + | Added lines |
| < | Changed lines |
| > | Changed lines |