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customNonbonded.cu 164 Bytes
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Peter Eastman's avatar
Continuing to implement new CUDA platform: CustomNonbondedForce, CustomHbondForce, CustomIntegrator  
Peter Eastman committed
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#ifdef USE_CUTOFF
if (!isExcluded && r2 < CUTOFF_SQUARED) {
#else
if (!isExcluded) {
#endif
    real tempForce = 0;
    COMPUTE_FORCE
    dEdR += tempForce*invR;
}