# | Line 17 | Line 17 | using namespace std; | |
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17 | #include "utils/simError.h" | |
18 | #include "UseTheForce/ForceFields.hpp" | |
19 | #include "primitives/Atom.hpp" | |
20 | < | #include "UseTheForce/fortranWrappers.hpp" |
20 | > | #include "UseTheForce/doForces_interface.h" |
21 | ||
22 | ||
23 | void ForceFields::calcRcut( void ){ | |
# | Line 168 | Line 168 | void ForceFields::doForces( int calcPot, int calcStres | |
168 | startProfile(pro8); | |
169 | #endif | |
170 | ||
171 | < | fortranForceLoop( pos, |
171 | > | doForceLoop( pos, |
172 | rc, | |
173 | A, | |
174 | u_l, |
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