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Commit 9425210a authored by Mark Friedrichs's avatar Mark Friedrichs
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Applied rev 3035 fix for OpenCL OBC Born to all code blocks

parent a955feb1
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platforms/opencl/src/kernels/gbsaObc_nvidia.cl
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...@@ -176,7 +176,7 @@ __kernel void computeBornSum( ...@@ -176,7 +176,7 @@ __kernel void computeBornSum(
float ratio = LOG(u_ij * RECIP(l_ij)); float ratio = LOG(u_ij * RECIP(l_ij));
bornSum += l_ij - u_ij + (0.50f*invR*ratio) + 0.25f*(r*(u_ij2-l_ij2) + bornSum += l_ij - u_ij + (0.50f*invR*ratio) + 0.25f*(r*(u_ij2-l_ij2) +
(params2.y*params2.y*invR)*(l_ij2-u_ij2)); (params2.y*params2.y*invR)*(l_ij2-u_ij2));
if (params1.x < params2.x-r) if (params1.x < params2.y-r)
bornSum += 2.0f*(RECIP(params1.x)-l_ij); bornSum += 2.0f*(RECIP(params1.x)-l_ij);
} }
float rScaledRadiusI = r+params1.y; float rScaledRadiusI = r+params1.y;
...@@ -235,7 +235,7 @@ __kernel void computeBornSum( ...@@ -235,7 +235,7 @@ __kernel void computeBornSum(
float ratio = LOG(u_ij * RECIP(l_ij)); float ratio = LOG(u_ij * RECIP(l_ij));
bornSum += l_ij - u_ij + (0.50f*invR*ratio) + 0.25f*(r*(u_ij2-l_ij2) + bornSum += l_ij - u_ij + (0.50f*invR*ratio) + 0.25f*(r*(u_ij2-l_ij2) +
(params2.y*params2.y*invR)*(l_ij2-u_ij2)); (params2.y*params2.y*invR)*(l_ij2-u_ij2));
if (params1.x < params2.x-r) if (params1.x < params2.y-r)
bornSum += 2.0f*(RECIP(params1.x)-l_ij); bornSum += 2.0f*(RECIP(params1.x)-l_ij);
} }
float rScaledRadiusI = r+params1.y; float rScaledRadiusI = r+params1.y;
......
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