float4 exceptionParams = PARAMS[index]; real3 delta = make_real3(pos2.x-pos1.x, pos2.y-pos1.y, pos2.z-pos1.z); real r2 = delta.x*delta.x + delta.y*delta.y + delta.z*delta.z; real invR = RSQRT(r2); real sig2 = invR*exceptionParams.y; sig2 *= sig2; real sig6 = sig2*sig2*sig2; real dEdR = exceptionParams.z*(12.0f*sig6-6.0f)*sig6; real tempEnergy = exceptionParams.z*(sig6-1.0f)*sig6; dEdR += exceptionParams.x*invR; dEdR *= invR*invR; tempEnergy += exceptionParams.x*invR; energy += tempEnergy; delta *= dEdR; real3 force1 = -delta; real3 force2 = delta;