Make SETTLE setup code platform-agnostic

[alexxy/gromacs.git] / src / gromacs / mdlib / settle_gpu_internal_sycl.cpp

diff --git a/src/gromacs/mdlib/settle_gpu_internal_sycl.cpp b/src/gromacs/mdlib/settle_gpu_internal_sycl.cpp
new file mode 100644 (file)
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+++ b/src/gromacs/mdlib/settle_gpu_internal_sycl.cpp
@@ -0,0 +1,70 @@
+/*
+ * This file is part of the GROMACS molecular simulation package.
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+ * Mark Abraham, David van der Spoel, Berk Hess, and Erik Lindahl,
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+/*! \internal \file
+ *
+ * \brief SYCL-specific routines for the GPU implementation of SETTLE constraints algorithm.
+ *
+ * \author Artem Zhmurov <zhmurov@gmail.com>
+ *
+ * \ingroup module_mdlib
+ */
+
+#include "settle_gpu_internal.h"
+
+#include "gromacs/utility/gmxassert.h"
+
+namespace gmx
+{
+
+void launchSettleGpuKernel(const int /* numSettles */,
+                           const DeviceBuffer<WaterMolecule> /* d_atomIds */,
+                           const SettleParameters /* settleParameters */,
+                           const DeviceBuffer<Float3> /* d_x */,
+                           DeviceBuffer<Float3> /* d_xp */,
+                           const bool /* updateVelocities */,
+                           DeviceBuffer<Float3> /* d_v */,
+                           const real /* invdt */,
+                           const bool /* computeVirial */,
+                           DeviceBuffer<float> /* virialScaled */,
+                           const PbcAiuc /* pbcAiuc */,
+                           const DeviceStream& /* deviceStream */)
+{
+    // SYCL_TODO
+    GMX_RELEASE_ASSERT(false, "SETTLE is not yet implemented in SYCL.");
+
+    return;
+}
+
+} // namespace gmx