// Note: Legacy mdrun resizes the force buffer in mdAlgorithmsSetupAtomData()
// TopologyHolder has no access to the forces, so we are passing a nullptr
// TODO: Find a unique approach to resizing the forces in modular simulator (#3461)
- mdAlgorithmsSetupAtomData(cr, inputrec, globalTopology, localTopology_.get(), fr, nullptr,
- mdAtoms, constr, vsite, nullptr);
+ mdAlgorithmsSetupAtomData(
+ cr, inputrec, globalTopology, localTopology_.get(), fr, nullptr, mdAtoms, constr, vsite, nullptr);
}
// Send copy of initial topology to clients
updateLocalTopology();