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root/group/trunk/OOPSE-1.0/libBASS/TorsionStamp.cpp
Revision: 1334
Committed: Fri Jul 16 18:58:03 2004 UTC (19 years, 11 months ago) by gezelter
File size: 1233 byte(s)
Log Message:
Initial import of OOPSE-1.0 source tree

File Contents

# Content
1 #include <stdlib.h>
2 #include <string.h>
3
4 #include "TorsionStamp.hpp"
5
6 TorsionStamp::TorsionStamp(){
7
8 have_mbrs = 0;
9 have_constraint = 0;
10
11 unhandled = NULL;
12 have_extras = 0;
13 }
14
15 TorsionStamp::~TorsionStamp(){
16
17 if( unhandled != NULL ) delete unhandled;
18 }
19
20 void TorsionStamp::members( int the_a, int the_b, int the_c, int the_d ){
21
22 a = the_a;
23 b = the_b;
24 c = the_c;
25 d = the_d;
26 have_mbrs = 1;
27 }
28
29 void TorsionStamp::constrain( double the_constraint ){
30
31 constraint = the_constraint;
32 have_constraint = 1;
33 }
34
35 void TorsionStamp::assignString( char* lhs, char* rhs ){
36
37 if( unhandled == NULL ) unhandled = new LinkedAssign( lhs, rhs );
38 else unhandled->add( lhs, rhs );
39 have_extras = 1;
40 }
41
42 void TorsionStamp::assignDouble( char* lhs, double rhs ){
43
44 if( unhandled == NULL ) unhandled = new LinkedAssign( lhs, rhs );
45 else unhandled->add( lhs, rhs );
46 have_extras = 1;
47 }
48
49 void TorsionStamp::assignInt( char* lhs, int rhs ){
50
51 if( unhandled == NULL ) unhandled = new LinkedAssign( lhs, rhs );
52 else unhandled->add( lhs, rhs );
53 have_extras = 1;
54 }
55
56 char* TorsionStamp::checkMe(){
57
58 if( !have_mbrs ){
59 return strdup( "TorsionStamp error. Torsion was not given members." );
60 }
61
62 return NULL;
63 }