Code beautification with uncrustify
authorRoland Schulz <roland@utk.edu>
Fri, 18 Jan 2013 01:07:27 +0000 (20:07 -0500)
committerGerrit Code Review <gerrit@gerrit.gromacs.org>
Fri, 18 Jan 2013 20:22:06 +0000 (21:22 +0100)
commit3339ffd6be2736541b928446de39ce51293449c6
tree4d42efa0c255d7e8b43fdb46992dd67f5215a4f0
parent66ff3d6e8bf65cce7b3008e65719e333da5e83e3
Code beautification with uncrustify

We are going to try to keep our eyeballs from bleeding when we
read prehistoric code from this project while maintaining it.
So we need a point in time where release-4-6 gets beautiful
in tandem with master. That time is now.

At some point we hope to be able to do this automatically so
we can have reviewers concentrate on code quality and not
formatting trivia. But we have to do a whole-of-project
fix first.

Refs #845

Change-Id: I8e99228cc118f75c0831e8297c171fcbbabc8f73
894 files changed:
admin/uncrustify.cfg [new file with mode: 0644]
include/3dview.h
include/assert.h
include/atomprop.h
include/bondf.h
include/calcgrid.h
include/calch.h
include/calcmu.h
include/chargegroup.h
include/checkpoint.h
include/confio.h
include/constr.h
include/copyrite.h
include/coulomb.h
include/disre.h
include/do_fit.h
include/domdec.h
include/domdec_network.h
include/ebin.h
include/edsam.h
include/enxio.h
include/ffscanf.h
include/filenm.h
include/force.h
include/futil.h
include/gbutil.h
include/gen_ad.h
include/genborn.h
include/gmx_ana.h
include/gmx_arpack.h
include/gmx_avx_double.h
include/gmx_avx_single.h
include/gmx_blas.h
include/gmx_cpuid.h
include/gmx_cyclecounter.h
include/gmx_fatal.h
include/gmx_fatal_collective.h
include/gmx_fft.h
include/gmx_ga2la.h
include/gmx_hash.h
include/gmx_lapack.h
include/gmx_math_x86_avx_128_fma_double.h
include/gmx_math_x86_avx_128_fma_single.h
include/gmx_math_x86_avx_256_double.h
include/gmx_math_x86_avx_256_single.h
include/gmx_math_x86_sse2_double.h
include/gmx_math_x86_sse2_single.h
include/gmx_math_x86_sse4_1_double.h
include/gmx_math_x86_sse4_1_single.h
include/gmx_matrix.h
include/gmx_omp_nthreads.h
include/gmx_parallel_3dfft.h
include/gmx_random.h
include/gmx_simd_macros.h
include/gmx_sort.h
include/gmx_statistics.h
include/gmx_system_xdr.h
include/gmx_thread_affinity.h
include/gmx_wallcycle.h
include/gmx_x86_avx_128_fma.h
include/gmx_x86_avx_256.h
include/gmx_x86_simd_double.h
include/gmx_x86_simd_single.h
include/gmx_x86_sse2.h
include/gmx_x86_sse4_1.h
include/gmxcomplex.h
include/gmxcpp.h
include/gmxfio.h
include/gpp_atomtype.h
include/gpp_nextnb.h
include/gpu_utils.h
include/grompp.h
include/gstat.h
include/hackblock.h
include/histogram.h
include/index.h
include/indexutil.h
include/invblock.h
include/macros.h
include/main.h
include/mainpage.h
include/maths.h
include/matio.h
include/md5.h
include/md_logging.h
include/md_support.h
include/mdatoms.h
include/mdebin.h
include/mdrun.h
include/mpelogging.h
include/mshift.h
include/mtop_util.h
include/mtxio.h
include/mvdata.h
include/names.h
include/nbnxn_cuda_data_mgmt.h
include/network.h
include/nonbonded.h
include/nrama.h
include/nrjac.h
include/nrnb.h
include/ns.h
include/nsgrid.h
include/oenv.h
include/orires.h
include/partdec.h
include/pbc.h
include/pdb2top.h
include/pdbio.h
include/perf_est.h
include/physics.h
include/pmalloc_cuda.h
include/pme.h
include/princ.h
include/pull.h
include/pull_rotation.h
include/qmmm.h
include/random.h
include/rbin.h
include/readinp.h
include/resall.h
include/rmpbc.h
include/selection.h
include/selmethod.h
include/selvalue.h
include/sfactor.h
include/shellfc.h
include/shift.h
include/sighandler.h
include/sim_util.h
include/smalloc.h
include/sortwater.h
include/sparsematrix.h
include/split.h
include/splitter.h
include/statutil.h
include/strdb.h
include/string2.h
include/symtab.h
include/sysstuff.h
include/tables.h
include/tgroup.h
include/thread_mpi.h
include/thread_mpi/atomic.h
include/thread_mpi/atomic/cycles.h
include/thread_mpi/atomic/gcc.h
include/thread_mpi/atomic/gcc_ia64.h
include/thread_mpi/atomic/gcc_intrinsics.h
include/thread_mpi/atomic/gcc_ppc.h
include/thread_mpi/atomic/gcc_spinlock.h
include/thread_mpi/atomic/gcc_x86.h
include/thread_mpi/atomic/msvc.h
include/thread_mpi/atomic/suncc-sparc.h
include/thread_mpi/atomic/xlc_ppc.h
include/thread_mpi/barrier.h
include/thread_mpi/collective.h
include/thread_mpi/event.h
include/thread_mpi/hwinfo.h
include/thread_mpi/list.h
include/thread_mpi/lock.h
include/thread_mpi/mpi_bindings.h
include/thread_mpi/mutex.h
include/thread_mpi/numa_malloc.h
include/thread_mpi/system_error.h
include/thread_mpi/threads.h
include/thread_mpi/tmpi.h
include/thread_mpi/visibility.h
include/thread_mpi/wait.h
include/tmpi.h
include/topsort.h
include/toputil.h
include/tpxio.h
include/trajana.h
include/trnio.h
include/txtdump.h
include/typedefs.h
include/types/atoms.h
include/types/block.h
include/types/commrec.h
include/types/energy.h
include/types/enums.h
include/types/fcdata.h
include/types/filenm.h
include/types/force_flags.h
include/types/forcerec.h
include/types/genborn.h
include/types/globsig.h
include/types/graph.h
include/types/group.h
include/types/hw_info.h
include/types/idef.h
include/types/ifunc.h
include/types/inputrec.h
include/types/interaction_const.h
include/types/ishift.h
include/types/iteratedconstraints.h
include/types/matrix.h
include/types/mdatom.h
include/types/nb_verlet.h
include/types/nblist.h
include/types/nbnxn_cuda_types_ext.h
include/types/nbnxn_pairlist.h
include/types/nlistheuristics.h
include/types/nrnb.h
include/types/ns.h
include/types/nsgrid.h
include/types/oenv.h
include/types/pbc.h
include/types/qmmmrec.h
include/types/simple.h
include/types/state.h
include/types/symtab.h
include/types/topology.h
include/types/trx.h
include/update.h
include/vcm.h
include/vec.h
include/viewit.h
include/visibility.h
include/vsite.h
include/warninp.h
include/wgms.h
include/wman.h
include/writeps.h
include/xdrf.h
include/xtcio.h
include/xvgr.h
src/gmxlib/3dview.c
src/gmxlib/atomprop.c
src/gmxlib/bondfree.c
src/gmxlib/calcgrid.c
src/gmxlib/calch.c
src/gmxlib/chargegroup.c
src/gmxlib/checkpoint.c
src/gmxlib/cinvsqrtdata.c
src/gmxlib/confio.c
src/gmxlib/copyrite.c
src/gmxlib/crecipdata.c
src/gmxlib/debugb.h
src/gmxlib/disre.c
src/gmxlib/dlb.h
src/gmxlib/do_fit.c
src/gmxlib/enxio.c
src/gmxlib/ewald_util.c
src/gmxlib/ffscanf.c
src/gmxlib/filenm.c
src/gmxlib/futil.c
src/gmxlib/gbutil.c
src/gmxlib/gmx_arpack.c
src/gmxlib/gmx_cpuid.c
src/gmxlib/gmx_cyclecounter.c
src/gmxlib/gmx_detect_hardware.c
src/gmxlib/gmx_fatal.c
src/gmxlib/gmx_matrix.c
src/gmxlib/gmx_omp.c
src/gmxlib/gmx_omp_nthreads.c
src/gmxlib/gmx_random.c
src/gmxlib/gmx_random_gausstable.h
src/gmxlib/gmx_sort.c
src/gmxlib/gmx_system_xdr.c
src/gmxlib/gmx_thread_affinity.c
src/gmxlib/gmxcpp.c
src/gmxlib/gmxfio.c
src/gmxlib/gmxfio_asc.c
src/gmxlib/gmxfio_bin.c
src/gmxlib/gmxfio_int.h
src/gmxlib/gmxfio_rw.c
src/gmxlib/gmxfio_xdr.c
src/gmxlib/gpu_utils/dummy.cpp
src/gmxlib/gpu_utils/memtestG80_core.h
src/gmxlib/ifunc.c
src/gmxlib/index.c
src/gmxlib/inputrec.c
src/gmxlib/invblock.c
src/gmxlib/invsqrt_test.c
src/gmxlib/libxdrf.c
src/gmxlib/main.c
src/gmxlib/maths.c
src/gmxlib/matio.c
src/gmxlib/md5.c
src/gmxlib/md_logging.c
src/gmxlib/minvert.h
src/gmxlib/molfile_plugin.h
src/gmxlib/mshift.c
src/gmxlib/mtop_util.c
src/gmxlib/mtxio.c
src/gmxlib/mvdata.c
src/gmxlib/names.c
src/gmxlib/network.c
src/gmxlib/nonbonded/nb_free_energy.c
src/gmxlib/nonbonded/nb_free_energy.h
src/gmxlib/nonbonded/nb_generic.c
src/gmxlib/nonbonded/nb_generic.h
src/gmxlib/nonbonded/nb_generic_adress.c
src/gmxlib/nonbonded/nb_generic_adress.h
src/gmxlib/nonbonded/nb_generic_cg.c
src/gmxlib/nonbonded/nb_generic_cg.h
src/gmxlib/nonbonded/nb_kernel.c
src/gmxlib/nonbonded/nb_kernel.h
src/gmxlib/nonbonded/nb_kernel_avx_128_fma_double/kernelutil_x86_avx_128_fma_double.h
src/gmxlib/nonbonded/nb_kernel_avx_128_fma_double/nb_kernel_avx_128_fma_double.c
src/gmxlib/nonbonded/nb_kernel_avx_128_fma_double/nb_kernel_avx_128_fma_double.h
src/gmxlib/nonbonded/nb_kernel_avx_128_fma_single/kernelutil_x86_avx_128_fma_single.h
src/gmxlib/nonbonded/nb_kernel_avx_128_fma_single/nb_kernel_avx_128_fma_single.c
src/gmxlib/nonbonded/nb_kernel_avx_128_fma_single/nb_kernel_avx_128_fma_single.h
src/gmxlib/nonbonded/nb_kernel_avx_256_double/kernelutil_x86_avx_256_double.h
src/gmxlib/nonbonded/nb_kernel_avx_256_double/nb_kernel_avx_256_double.c
src/gmxlib/nonbonded/nb_kernel_avx_256_double/nb_kernel_avx_256_double.h
src/gmxlib/nonbonded/nb_kernel_avx_256_single/kernelutil_x86_avx_256_single.h
src/gmxlib/nonbonded/nb_kernel_avx_256_single/nb_kernel_avx_256_single.c
src/gmxlib/nonbonded/nb_kernel_avx_256_single/nb_kernel_avx_256_single.h
src/gmxlib/nonbonded/nb_kernel_c/nb_kernel_allvsall.c
src/gmxlib/nonbonded/nb_kernel_c/nb_kernel_allvsallgb.c
src/gmxlib/nonbonded/nb_kernel_c/nb_kernel_c.c
src/gmxlib/nonbonded/nb_kernel_c/nb_kernel_c.h
src/gmxlib/nonbonded/nb_kernel_sse2_double/kernelutil_x86_sse2_double.h
src/gmxlib/nonbonded/nb_kernel_sse2_double/nb_kernel_sse2_double.c
src/gmxlib/nonbonded/nb_kernel_sse2_double/nb_kernel_sse2_double.h
src/gmxlib/nonbonded/nb_kernel_sse2_single/kernelutil_x86_sse2_single.h
src/gmxlib/nonbonded/nb_kernel_sse2_single/nb_kernel_sse2_single.c
src/gmxlib/nonbonded/nb_kernel_sse2_single/nb_kernel_sse2_single.h
src/gmxlib/nonbonded/nb_kernel_sse4_1_double/kernelutil_x86_sse4_1_double.h
src/gmxlib/nonbonded/nb_kernel_sse4_1_double/nb_kernel_sse4_1_double.c
src/gmxlib/nonbonded/nb_kernel_sse4_1_double/nb_kernel_sse4_1_double.h
src/gmxlib/nonbonded/nb_kernel_sse4_1_single/kernelutil_x86_sse4_1_single.h
src/gmxlib/nonbonded/nb_kernel_sse4_1_single/nb_kernel_sse4_1_single.c
src/gmxlib/nonbonded/nb_kernel_sse4_1_single/nb_kernel_sse4_1_single.h
src/gmxlib/nonbonded/nonbonded.c
src/gmxlib/nrama.c
src/gmxlib/nrjac.c
src/gmxlib/nrnb.c
src/gmxlib/oenv.c
src/gmxlib/orires.c
src/gmxlib/pargs.c
src/gmxlib/pbc.c
src/gmxlib/pdbio.c
src/gmxlib/princ.c
src/gmxlib/rando.c
src/gmxlib/random.c
src/gmxlib/rbin.c
src/gmxlib/readinp.c
src/gmxlib/replace.c
src/gmxlib/replace.h
src/gmxlib/rmpbc.c
src/gmxlib/selection/compiler.c
src/gmxlib/selection/evaluate.c
src/gmxlib/selection/evaluate.h
src/gmxlib/selection/keywords.h
src/gmxlib/selection/mempool.c
src/gmxlib/selection/params.c
src/gmxlib/selection/parsetree.c
src/gmxlib/selection/parsetree.h
src/gmxlib/selection/scanner_internal.c
src/gmxlib/selection/scanner_internal.h
src/gmxlib/selection/selcollection.h
src/gmxlib/selection/selection.c
src/gmxlib/selection/selelem.c
src/gmxlib/selection/selelem.h
src/gmxlib/selection/selhelp.c
src/gmxlib/selection/selmethod.c
src/gmxlib/selection/sm_compare.c
src/gmxlib/selection/sm_distance.c
src/gmxlib/selection/sm_insolidangle.c
src/gmxlib/selection/sm_keywords.c
src/gmxlib/selection/sm_merge.c
src/gmxlib/selection/sm_permute.c
src/gmxlib/selection/sm_position.c
src/gmxlib/selection/sm_same.c
src/gmxlib/selection/sm_simple.c
src/gmxlib/selection/symrec.c
src/gmxlib/selection/test_selection.c
src/gmxlib/sfactor.c
src/gmxlib/shift_util.c
src/gmxlib/sighandler.c
src/gmxlib/smalloc.c
src/gmxlib/sortwater.c
src/gmxlib/sparsematrix.c
src/gmxlib/splitter.c
src/gmxlib/statistics/gmx_statistics.c
src/gmxlib/statistics/gmx_statistics_test.c
src/gmxlib/statistics/histogram.c
src/gmxlib/statutil.c
src/gmxlib/strdb.c
src/gmxlib/string2.c
src/gmxlib/symtab.c
src/gmxlib/tcontrol.c
src/gmxlib/thread_mpi/alltoall.c
src/gmxlib/thread_mpi/barrier.c
src/gmxlib/thread_mpi/bcast.c
src/gmxlib/thread_mpi/collective.c
src/gmxlib/thread_mpi/collective.h
src/gmxlib/thread_mpi/comm.c
src/gmxlib/thread_mpi/errhandler.c
src/gmxlib/thread_mpi/event.c
src/gmxlib/thread_mpi/gather.c
src/gmxlib/thread_mpi/group.c
src/gmxlib/thread_mpi/impl.h
src/gmxlib/thread_mpi/list.c
src/gmxlib/thread_mpi/lock.c
src/gmxlib/thread_mpi/numa_malloc.c
src/gmxlib/thread_mpi/once.c
src/gmxlib/thread_mpi/p2p.h
src/gmxlib/thread_mpi/p2p_buffer.c
src/gmxlib/thread_mpi/p2p_protocol.c
src/gmxlib/thread_mpi/p2p_send_recv.c
src/gmxlib/thread_mpi/p2p_wait.c
src/gmxlib/thread_mpi/profile.c
src/gmxlib/thread_mpi/profile.h
src/gmxlib/thread_mpi/pthreads.c
src/gmxlib/thread_mpi/pthreads.h
src/gmxlib/thread_mpi/reduce.c
src/gmxlib/thread_mpi/reduce_fast.c
src/gmxlib/thread_mpi/scan.c
src/gmxlib/thread_mpi/scatter.c
src/gmxlib/thread_mpi/settings.h
src/gmxlib/thread_mpi/system_error.cpp
src/gmxlib/thread_mpi/tmpi_init.c
src/gmxlib/thread_mpi/tmpi_malloc.c
src/gmxlib/thread_mpi/tmpi_ops.h
src/gmxlib/thread_mpi/topology.c
src/gmxlib/thread_mpi/type.c
src/gmxlib/thread_mpi/winthreads.c
src/gmxlib/thread_mpi/winthreads.h
src/gmxlib/topsort.c
src/gmxlib/tpxio.c
src/gmxlib/trajana/centerofmass.c
src/gmxlib/trajana/displacement.c
src/gmxlib/trajana/indexutil.c
src/gmxlib/trajana/nbsearch.c
src/gmxlib/trajana/poscalc.c
src/gmxlib/trajana/position.c
src/gmxlib/trajana/trajana.c
src/gmxlib/trnio.c
src/gmxlib/trxio.c
src/gmxlib/txtdump.c
src/gmxlib/typedefs.c
src/gmxlib/viewit.c
src/gmxlib/vmddlopen.c
src/gmxlib/vmddlopen.h
src/gmxlib/vmdio.c
src/gmxlib/vmdio.h
src/gmxlib/vmdplugin.h
src/gmxlib/warninp.c
src/gmxlib/wgms.c
src/gmxlib/wman.c
src/gmxlib/writeps.c
src/gmxlib/xdrd.c
src/gmxlib/xtcio.c
src/gmxlib/xvgr.c
src/kernel/add_par.c
src/kernel/add_par.h
src/kernel/calc_verletbuf.c
src/kernel/calc_verletbuf.h
src/kernel/compute_io.c
src/kernel/compute_io.h
src/kernel/convparm.c
src/kernel/convparm.h
src/kernel/do_gct.c
src/kernel/fflibutil.c
src/kernel/fflibutil.h
src/kernel/g_luck.c
src/kernel/g_protonate.c
src/kernel/g_x2top.c
src/kernel/g_x2top.h
src/kernel/gctio.c
src/kernel/gen_ad.c
src/kernel/gen_vsite.c
src/kernel/gen_vsite.h
src/kernel/genalg.c
src/kernel/genalg.h
src/kernel/genhydro.c
src/kernel/genhydro.h
src/kernel/gmxcheck.c
src/kernel/gmxdump.c
src/kernel/gpp_atomtype.c
src/kernel/gpp_bond_atomtype.c
src/kernel/gpp_bond_atomtype.h
src/kernel/gpp_tomorse.h
src/kernel/grompp.c
src/kernel/h_db.c
src/kernel/h_db.h
src/kernel/hackblock.c
src/kernel/hizzie.c
src/kernel/hizzie.h
src/kernel/ionize.c
src/kernel/ionize.h
src/kernel/main.c
src/kernel/md.c
src/kernel/mdrun.c
src/kernel/membed.c
src/kernel/nm2type.c
src/kernel/pdb2gmx.c
src/kernel/pdb2top.c
src/kernel/pgutil.c
src/kernel/pgutil.h
src/kernel/pme_loadbal.c
src/kernel/pme_loadbal.h
src/kernel/readadress.c
src/kernel/readir.c
src/kernel/readir.h
src/kernel/readpull.c
src/kernel/readrot.c
src/kernel/repl_ex.c
src/kernel/repl_ex.h
src/kernel/resall.c
src/kernel/runner.c
src/kernel/sorting.c
src/kernel/sorting.h
src/kernel/specbond.c
src/kernel/specbond.h
src/kernel/ter_db.c
src/kernel/ter_db.h
src/kernel/tomorse.c
src/kernel/topdef.h
src/kernel/topdirs.c
src/kernel/topdirs.h
src/kernel/topexcl.c
src/kernel/topexcl.h
src/kernel/topio.c
src/kernel/topio.h
src/kernel/toppush.c
src/kernel/toppush.h
src/kernel/topshake.c
src/kernel/topshake.h
src/kernel/toputil.c
src/kernel/tpbcmp.c
src/kernel/tpbcmp.h
src/kernel/tpbconv.c
src/kernel/vsite_parm.c
src/kernel/vsite_parm.h
src/kernel/xlate.c
src/kernel/xlate.h
src/kernel/xmdrun.h
src/kernel/xutils.c
src/mdlib/adress.c
src/mdlib/adress.h
src/mdlib/calcmu.c
src/mdlib/calcvir.c
src/mdlib/clincs.c
src/mdlib/constr.c
src/mdlib/coupling.c
src/mdlib/csettle.c
src/mdlib/domdec.c
src/mdlib/domdec_box.c
src/mdlib/domdec_con.c
src/mdlib/domdec_network.c
src/mdlib/domdec_setup.c
src/mdlib/domdec_top.c
src/mdlib/ebin.c
src/mdlib/edsam.c
src/mdlib/ewald.c
src/mdlib/expanded.c
src/mdlib/fft5d.c
src/mdlib/fft5d.h
src/mdlib/fftpack.c
src/mdlib/fftpack.h
src/mdlib/force.c
src/mdlib/forcerec.c
src/mdlib/genborn.c
src/mdlib/genborn_allvsall.c
src/mdlib/genborn_allvsall.h
src/mdlib/genborn_allvsall_sse2_double.c
src/mdlib/genborn_allvsall_sse2_double.h
src/mdlib/genborn_allvsall_sse2_single.c
src/mdlib/genborn_allvsall_sse2_single.h
src/mdlib/genborn_sse2_double.c
src/mdlib/genborn_sse2_double.h
src/mdlib/genborn_sse2_single.c
src/mdlib/genborn_sse2_single.h
src/mdlib/gmx_fft.c
src/mdlib/gmx_fft_acml.c
src/mdlib/gmx_fft_fftpack.c
src/mdlib/gmx_fft_fftw3.c
src/mdlib/gmx_fft_mkl.c
src/mdlib/gmx_parallel_3dfft.c
src/mdlib/gmx_wallcycle.c
src/mdlib/groupcoord.c
src/mdlib/groupcoord.h
src/mdlib/init.c
src/mdlib/iteratedconstraints.c
src/mdlib/md_support.c
src/mdlib/mdatom.c
src/mdlib/mdebin.c
src/mdlib/mdebin_bar.c
src/mdlib/mdebin_bar.h
src/mdlib/minimize.c
src/mdlib/mvxvf.c
src/mdlib/nbnxn_atomdata.c
src/mdlib/nbnxn_atomdata.h
src/mdlib/nbnxn_cuda/nbnxn_cuda.h
src/mdlib/nbnxn_cuda/nbnxn_cuda_types.h
src/mdlib/nbnxn_internal.h
src/mdlib/nbnxn_kernels/nbnxn_kernel_common.c
src/mdlib/nbnxn_kernels/nbnxn_kernel_common.h
src/mdlib/nbnxn_kernels/nbnxn_kernel_gpu_ref.c
src/mdlib/nbnxn_kernels/nbnxn_kernel_gpu_ref.h
src/mdlib/nbnxn_kernels/nbnxn_kernel_ref.c
src/mdlib/nbnxn_kernels/nbnxn_kernel_ref.h
src/mdlib/nbnxn_kernels/nbnxn_kernel_ref_inner.h
src/mdlib/nbnxn_kernels/nbnxn_kernel_ref_outer.h
src/mdlib/nbnxn_kernels/nbnxn_kernel_simd_2xnn.c
src/mdlib/nbnxn_kernels/nbnxn_kernel_simd_2xnn.h
src/mdlib/nbnxn_kernels/nbnxn_kernel_simd_2xnn_inner.h
src/mdlib/nbnxn_kernels/nbnxn_kernel_simd_2xnn_outer.h
src/mdlib/nbnxn_kernels/nbnxn_kernel_simd_4xn.c
src/mdlib/nbnxn_kernels/nbnxn_kernel_simd_4xn.h
src/mdlib/nbnxn_kernels/nbnxn_kernel_simd_4xn_inner.h
src/mdlib/nbnxn_kernels/nbnxn_kernel_simd_4xn_outer.h
src/mdlib/nbnxn_kernels/nbnxn_kernel_simd_utils.h
src/mdlib/nbnxn_search.c
src/mdlib/nbnxn_search.h
src/mdlib/nbnxn_search_simd_2xnn.h
src/mdlib/nbnxn_search_simd_4xn.h
src/mdlib/nlistheuristics.c
src/mdlib/ns.c
src/mdlib/nsgrid.c
src/mdlib/partdec.c
src/mdlib/perf_est.c
src/mdlib/pme.c
src/mdlib/pme_pp.c
src/mdlib/pme_sse_single.h
src/mdlib/pull.c
src/mdlib/pull_rotation.c
src/mdlib/pullutil.c
src/mdlib/qm_gamess.c
src/mdlib/qm_gaussian.c
src/mdlib/qm_mopac.c
src/mdlib/qm_orca.c
src/mdlib/qmmm.c
src/mdlib/rf_util.c
src/mdlib/shakef.c
src/mdlib/shellfc.c
src/mdlib/sim_util.c
src/mdlib/stat.c
src/mdlib/tables.c
src/mdlib/tgroup.c
src/mdlib/tpi.c
src/mdlib/update.c
src/mdlib/vcm.c
src/mdlib/vsite.c
src/mdlib/wall.c
src/mdlib/wnblist.c
src/ngmx/Xstuff.h
src/ngmx/buttons.c
src/ngmx/buttons.h
src/ngmx/dialogs.c
src/ngmx/dialogs.h
src/ngmx/fgrid.c
src/ngmx/fgrid.h
src/ngmx/filter.c
src/ngmx/g_highway.c
src/ngmx/g_logo.c
src/ngmx/g_showcol.c
src/ngmx/g_xrama.c
src/ngmx/logo.c
src/ngmx/logo.h
src/ngmx/manager.c
src/ngmx/manager.h
src/ngmx/molps.c
src/ngmx/molps.h
src/ngmx/ngmx.c
src/ngmx/nleg.c
src/ngmx/nleg.h
src/ngmx/nmol.c
src/ngmx/nmol.h
src/ngmx/popup.c
src/ngmx/popup.h
src/ngmx/pulldown.c
src/ngmx/pulldown.h
src/ngmx/test_ngmx_dialog.c
src/ngmx/vbox.c
src/ngmx/x11.c
src/ngmx/x11.h
src/ngmx/xdlg.c
src/ngmx/xdlg.h
src/ngmx/xdlghi.c
src/ngmx/xdlghi.h
src/ngmx/xdlgitem.c
src/ngmx/xdlgitem.h
src/ngmx/xmb.c
src/ngmx/xmb.h
src/ngmx/xstat.c
src/ngmx/xutil.c
src/ngmx/xutil.h
src/tools/addconf.c
src/tools/addconf.h
src/tools/anadih.c
src/tools/angstat.h
src/tools/autocorr.c
src/tools/binsearch.c
src/tools/binsearch.h
src/tools/calcpot.c
src/tools/calcpot.h
src/tools/cmat.c
src/tools/cmat.h
src/tools/correl.c
src/tools/correl.h
src/tools/dens_filter.c
src/tools/dens_filter.h
src/tools/dlist.c
src/tools/do_dssp.c
src/tools/editconf.c
src/tools/edittop.c
src/tools/eigensolver.c
src/tools/eigensolver.h
src/tools/eigio.c
src/tools/eigio.h
src/tools/eneconv.c
src/tools/expfit.c
src/tools/fitahx.c
src/tools/fitahx.h
src/tools/g_anadock.c
src/tools/g_anaeig.c
src/tools/g_analyze.c
src/tools/g_angle.c
src/tools/g_bar.c
src/tools/g_bond.c
src/tools/g_bundle.c
src/tools/g_chi.c
src/tools/g_cluster.c
src/tools/g_clustsize.c
src/tools/g_confrms.c
src/tools/g_covar.c
src/tools/g_current.c
src/tools/g_density.c
src/tools/g_densmap.c
src/tools/g_densorder.c
src/tools/g_dielectric.c
src/tools/g_dipoles.c
src/tools/g_disre.c
src/tools/g_dist.c
src/tools/g_dos.c
src/tools/g_dyecoupl.c
src/tools/g_dyndom.c
src/tools/g_enemat.c
src/tools/g_energy.c
src/tools/g_filter.c
src/tools/g_gyrate.c
src/tools/g_h2order.c
src/tools/g_hbond.c
src/tools/g_helix.c
src/tools/g_helixorient.c
src/tools/g_hydorder.c
src/tools/g_kinetics.c
src/tools/g_lie.c
src/tools/g_mdmat.c
src/tools/g_membed.c
src/tools/g_mindist.c
src/tools/g_morph.c
src/tools/g_msd.c
src/tools/g_nmeig.c
src/tools/g_nmens.c
src/tools/g_nmtraj.c
src/tools/g_options.c
src/tools/g_order.c
src/tools/g_pme_error.c
src/tools/g_polystat.c
src/tools/g_potential.c
src/tools/g_principal.c
src/tools/g_rama.c
src/tools/g_rdf.c
src/tools/g_rms.c
src/tools/g_rmsdist.c
src/tools/g_rmsf.c
src/tools/g_rotacf.c
src/tools/g_rotmat.c
src/tools/g_saltbr.c
src/tools/g_sans.c
src/tools/g_sas.c
src/tools/g_sgangle.c
src/tools/g_sham.c
src/tools/g_sigeps.c
src/tools/g_sorient.c
src/tools/g_spatial.c
src/tools/g_spol.c
src/tools/g_tcaf.c
src/tools/g_traj.c
src/tools/g_tune_pme.c
src/tools/g_vanhove.c
src/tools/g_velacc.c
src/tools/g_wham.c
src/tools/g_wheel.c
src/tools/geminate.c
src/tools/geminate.h
src/tools/genbox.c
src/tools/genconf.c
src/tools/genion.c
src/tools/genrestr.c
src/tools/gmx_anadock.c
src/tools/gmx_anaeig.c
src/tools/gmx_analyze.c
src/tools/gmx_angle.c
src/tools/gmx_bar.c
src/tools/gmx_bond.c
src/tools/gmx_bundle.c
src/tools/gmx_chi.c
src/tools/gmx_cluster.c
src/tools/gmx_clustsize.c
src/tools/gmx_confrms.c
src/tools/gmx_covar.c
src/tools/gmx_current.c
src/tools/gmx_density.c
src/tools/gmx_densmap.c
src/tools/gmx_densorder.c
src/tools/gmx_dielectric.c
src/tools/gmx_dipoles.c
src/tools/gmx_disre.c
src/tools/gmx_dist.c
src/tools/gmx_do_dssp.c
src/tools/gmx_dos.c
src/tools/gmx_dyecoupl.c
src/tools/gmx_dyndom.c
src/tools/gmx_editconf.c
src/tools/gmx_eneconv.c
src/tools/gmx_enemat.c
src/tools/gmx_energy.c
src/tools/gmx_filter.c
src/tools/gmx_genbox.c
src/tools/gmx_genconf.c
src/tools/gmx_genion.c
src/tools/gmx_genpr.c
src/tools/gmx_gyrate.c
src/tools/gmx_h2order.c
src/tools/gmx_hbond.c
src/tools/gmx_helix.c
src/tools/gmx_helixorient.c
src/tools/gmx_hydorder.c
src/tools/gmx_kinetics.c
src/tools/gmx_lie.c
src/tools/gmx_make_edi.c
src/tools/gmx_make_ndx.c
src/tools/gmx_mdmat.c
src/tools/gmx_membed.c
src/tools/gmx_mindist.c
src/tools/gmx_mk_angndx.c
src/tools/gmx_morph.c
src/tools/gmx_msd.c
src/tools/gmx_nmeig.c
src/tools/gmx_nmens.c
src/tools/gmx_nmtraj.c
src/tools/gmx_options.c
src/tools/gmx_order.c
src/tools/gmx_pme_error.c
src/tools/gmx_polystat.c
src/tools/gmx_potential.c
src/tools/gmx_principal.c
src/tools/gmx_rama.c
src/tools/gmx_rdf.c
src/tools/gmx_rms.c
src/tools/gmx_rmsdist.c
src/tools/gmx_rmsf.c
src/tools/gmx_rotacf.c
src/tools/gmx_rotmat.c
src/tools/gmx_saltbr.c
src/tools/gmx_sans.c
src/tools/gmx_sas.c
src/tools/gmx_select.c
src/tools/gmx_sgangle.c
src/tools/gmx_sham.c
src/tools/gmx_sigeps.c
src/tools/gmx_sorient.c
src/tools/gmx_spatial.c
src/tools/gmx_spol.c
src/tools/gmx_tcaf.c
src/tools/gmx_traj.c
src/tools/gmx_trjcat.c
src/tools/gmx_trjconv.c
src/tools/gmx_trjorder.c
src/tools/gmx_tune_pme.c
src/tools/gmx_vanhove.c
src/tools/gmx_velacc.c
src/tools/gmx_wham.c
src/tools/gmx_wheel.c
src/tools/gmx_xpm2ps.c
src/tools/hxprops.c
src/tools/hxprops.h
src/tools/interf.h
src/tools/levenmar.c
src/tools/make_edi.c
src/tools/make_ndx.c
src/tools/mk_angndx.c
src/tools/nsc.c
src/tools/nsc.h
src/tools/nsfactor.c
src/tools/nsfactor.h
src/tools/polynomials.c
src/tools/powerspect.c
src/tools/powerspect.h
src/tools/pp2shift.c
src/tools/pp2shift.h
src/tools/trjcat.c
src/tools/trjconv.c
src/tools/trjorder.c
src/tools/xpm2ps.c