port DPD exclusions corrections to GPU package

2023-01-02 12:04:10 -05:00
parent 37b3ba827f
commit 396d577f40
5 changed files with 43 additions and 20 deletions
--- a/lib/gpu/lal_dpd.h
+++ b/lib/gpu/lal_dpd.h
@ -65,7 +65,7 @@ class DPD : public BaseDPD<numtyp, acctyp> {
  UCL_D_Vec<numtyp> cutsq;

  /// Special LJ values
-  UCL_D_Vec<numtyp> sp_lj;
+  UCL_D_Vec<numtyp> sp_lj, sp_sqrt;

  /// If atom type constants fit in shared memory, use fast kernels
  bool shared_types;