# | Line 184 | Line 184 | template<typename T> void Integrator<T>::integrate( vo | |
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184 | // initialize the forces before the first step | |
185 | ||
186 | calcForce(1, 1); | |
187 | < | |
187 | > | // myFF->doForces(1,1); |
188 | > | |
189 | if( info->setTemp ){ | |
190 | ||
191 | thermalize(); |
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