# | Line 127 | Line 127 | void MoLocator::calcRefCoords( void ){ | |
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127 | refMolCom += refCoords[i] * mass[i]; | |
128 | totMass += mass[i]; | |
129 | } | |
130 | < | refMolCom / = totMass; |
130 | > | |
131 | > | refMolCom /= totMass; |
132 | ||
133 | //move the reference center of mass to (0,0,0) and adjust the reference coordinate | |
134 | //of the integrabel objects |
– | Removed lines |
+ | Added lines |
< | Changed lines |
> | Changed lines |