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Commit 1ded9a60 authored by Peter Eastman's avatar Peter Eastman
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Fixed bug computing energies without forces

parent 7e114fb5
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Showing with 3 additions and 3 deletions
platforms/cuda/src/kernels/nonbonded.cu
View file @ 1ded9a60
......@@ -278,10 +278,10 @@ extern "C" __global__ void computeNonbonded(
localData[tbx+tj].fz += dEdR2.z;
#endif
#endif // end USE_SYMMETRIC
#endif
#ifdef ENABLE_SHUFFLE
SHUFFLE_WARP_DATA
#endif
#endif
#ifdef USE_EXCLUSIONS
excl >>= 1;
#endif
......@@ -484,9 +484,9 @@ extern "C" __global__ void computeNonbonded(
localData[tbx+tj].fz += dEdR2.z;
#endif
#endif // end USE_SYMMETRIC
#endif
#ifdef ENABLE_SHUFFLE
SHUFFLE_WARP_DATA
#endif
#endif
tj = (tj + 1) & (TILE_SIZE - 1);
}
......@@ -555,9 +555,9 @@ extern "C" __global__ void computeNonbonded(
localData[tbx+tj].fz += dEdR2.z;
#endif
#endif // end USE_SYMMETRIC
#endif
#ifdef ENABLE_SHUFFLE
SHUFFLE_WARP_DATA
#endif
#endif
tj = (tj + 1) & (TILE_SIZE - 1);
}
......
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