PG-PuReMD/src · 1ea20ff7f5a87b2e01878ff5350376ed31eda6b6 · SParTA / PuReMD

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PG-PuReMD: fix nvcc build issue where incorrect C++ compiler was utilized. Fix...

PG-PuReMD: fix nvcc build issue where incorrect C++ compiler was utilized. Fix race condition with three body list computation. Remove debug code. Other misc. refactoring.

b73145d4

History

b73145d4 7 years ago

History

Name	Last commit	Last update
..
allocate.c
allocate.h
analyze.c
analyze.h
basic_comm.c
basic_comm.h
bond_orders.c
bond_orders.h
bonds.c
bonds.h
box.c
box.h
center_mass.cu
center_mass.h
charges.c
charges.h
comm_tools.c
comm_tools.h
control.c
control.h
cuda_allocate.cu
cuda_allocate.h
cuda_bond_orders.cu
cuda_bond_orders.h
cuda_bonds.cu
cuda_bonds.h
cuda_charges.cu
cuda_charges.h
cuda_copy.cu
cuda_copy.h
cuda_environment.cu
cuda_environment.h
cuda_forces.cu
cuda_forces.h
cuda_helpers.h
cuda_hydrogen_bonds.cu
cuda_hydrogen_bonds.h
cuda_init_md.cu
cuda_init_md.h
cuda_integrate.cu
cuda_integrate.h
cuda_lin_alg.cu
cuda_lin_alg.h
cuda_list.cu
cuda_list.h
cuda_lookup.cu
cuda_lookup.h
cuda_multi_body.cu
cuda_multi_body.h
cuda_neighbors.cu
cuda_neighbors.h
cuda_nonbonded.cu
cuda_nonbonded.h
cuda_post_evolve.cu
cuda_post_evolve.h
cuda_reduction.cu
cuda_reduction.h
cuda_reset_tools.cu
cuda_reset_tools.h
cuda_shuffle.h
cuda_system_props.cu
cuda_system_props.h
cuda_torsion_angles.cu
cuda_torsion_angles.h
cuda_utils.cu
cuda_utils.h
cuda_valence_angles.cu
cuda_valence_angles.h
cuda_validation.cu
cuda_validation.h
ffield.c
ffield.h
forces.c
forces.h
geo_tools.c
geo_tools.h
grid.c
grid.h
hydrogen_bonds.c
hydrogen_bonds.h
index_utils.h
init_md.c
init_md.h
integrate.c
integrate.h
io_tools.c
io_tools.h
lin_alg.c
lin_alg.h
list.c
list.h
lookup.c
lookup.h
multi_body.c
multi_body.h
neighbors.c
neighbors.h
nonbonded.c
nonbonded.h
parallelreax.c