| 32 |
|
SSDAtomVisitor* ssdVisitor; |
| 33 |
|
DefaultAtomVisitor* defaultAtomVisitor; |
| 34 |
|
LipidHeadVisitor* lipidVisitor; |
| 35 |
+ |
RBCOMVisitor* rbCOMVisitor; |
| 36 |
|
ReplicateVisitor* replicateVisitor; |
| 37 |
|
WrappingVisitor* wrappingVisitor; |
| 38 |
|
IgnoreVisitor* ignoreVisitor; |
| 39 |
|
XYZVisitor* xyzVisitor; |
| 40 |
|
ZConsVisitor* zconsVisitor; |
| 41 |
|
PrepareVisitor* prepareVisitor; |
| 42 |
+ |
WaterTypeVisitor* waterTypeVisitor; |
| 43 |
|
|
| 44 |
|
//parse the command line option |
| 45 |
|
if (cmdline_parser (argc, argv, &args_info) != 0) |
| 102 |
|
} |
| 103 |
|
|
| 104 |
|
//creat RigidBody Visitor |
| 105 |
+ |
if(args_info.rigidbody_flag){ |
| 106 |
+ |
rbCOMVisitor = new RBCOMVisitor(info); |
| 107 |
+ |
compositeVisitor->addVisitor(rbCOMVisitor, 900); |
| 108 |
+ |
} |
| 109 |
+ |
//creat RigidBody Visitor |
| 110 |
|
//lipidVisitor = new LipidHeadVisitor(info); |
| 111 |
|
|
| 112 |
|
//adding names of lipid head group |
| 116 |
|
//compositeVisitor->addVisitor(lipidVisitor, 900); |
| 117 |
|
|
| 118 |
|
//creat SSD atom visitor |
| 119 |
< |
//ssdVisitor = new SSDAtomVisitor(info); |
| 120 |
< |
//compositeVisitor->addVisitor(ssdVisitor, 800); |
| 119 |
> |
ssdVisitor = new SSDAtomVisitor(info); |
| 120 |
> |
compositeVisitor->addVisitor(ssdVisitor, 800); |
| 121 |
|
|
| 122 |
|
//creat default atom visitor |
| 123 |
|
defaultAtomVisitor = new DefaultAtomVisitor(info); |
| 124 |
|
compositeVisitor->addVisitor(defaultAtomVisitor, 700); |
| 125 |
|
|
| 126 |
+ |
//creat waterType visitor |
| 127 |
+ |
if(args_info.watertype_flag){ |
| 128 |
+ |
waterTypeVisitor = new WaterTypeVisitor; |
| 129 |
+ |
compositeVisitor->addVisitor(waterTypeVisitor, 600); |
| 130 |
+ |
} |
| 131 |
+ |
|
| 132 |
|
//create ZconsVisitor |
| 133 |
< |
if(args_info.replace_given){ |
| 133 |
> |
if(args_info.zconstraint_flag){ |
| 134 |
|
|
| 135 |
|
zconsVisitor = new ZConsVisitor(info); |
| 136 |
|
|
| 137 |
|
if(zconsVisitor->haveZconsMol()) |
| 138 |
< |
compositeVisitor->addVisitor(zconsVisitor, 600); |
| 138 |
> |
compositeVisitor->addVisitor(zconsVisitor, 500); |
| 139 |
|
else |
| 140 |
|
delete zconsVisitor; |
| 141 |
|
} |
| 144 |
|
|
| 145 |
|
if(args_info.periodicBox_flag){ |
| 146 |
|
wrappingVisitor = new WrappingVisitor(info); |
| 147 |
< |
compositeVisitor->addVisitor(wrappingVisitor, 500); |
| 147 |
> |
compositeVisitor->addVisitor(wrappingVisitor, 400); |
| 148 |
|
} |
| 149 |
|
|
| 150 |
|
//creat replicate visitor |
| 151 |
|
if(args_info.repeatX_given > 0 || args_info.repeatY_given > 0 ||args_info.repeatY_given > 0){ |
| 152 |
|
IntVec3 replicateOpt(args_info.repeatX_arg, args_info.repeatY_arg, args_info.repeatZ_arg); |
| 153 |
|
replicateVisitor = new ReplicateVisitor(info, replicateOpt); |
| 154 |
< |
compositeVisitor->addVisitor(replicateVisitor, 400); |
| 154 |
> |
compositeVisitor->addVisitor(replicateVisitor, 300); |
| 155 |
|
} |
| 156 |
|
|
| 157 |
|
//creat xyzVisitor |
| 158 |
|
xyzVisitor = new XYZVisitor(info); |
| 159 |
< |
compositeVisitor->addVisitor(xyzVisitor, 300); |
| 159 |
> |
compositeVisitor->addVisitor(xyzVisitor, 200); |
| 160 |
|
|
| 161 |
|
cout << compositeVisitor->toString(); |
| 162 |
|
|