|
Name |
|
Date |
Size |
#Lines |
LOC |
| .. | | 03-May-2022 | - |
| tests/ | H | 03-May-2022 | - | 1,426 | 1,070 |
| anadih.cpp | H A D | 05-Nov-2021 | 30.7 KiB | 1,027 | 831 |
| angle_correction.cpp | H A D | 05-Nov-2021 | 2.1 KiB | 57 | 18 |
| angle_correction.h | H A D | 05-Nov-2021 | 2 KiB | 49 | 5 |
| binsearch.cpp | H A D | 05-Nov-2021 | 4.6 KiB | 191 | 130 |
| binsearch.h | H A D | 05-Nov-2021 | 2.2 KiB | 52 | 9 |
| cmat.cpp | H A D | 05-Nov-2021 | 6.3 KiB | 258 | 184 |
| cmat.h | H A D | 05-Nov-2021 | 2.9 KiB | 95 | 37 |
| dens_filter.cpp | H A D | 05-Nov-2021 | 3.9 KiB | 147 | 82 |
| dens_filter.h | H A D | 05-Nov-2021 | 2 KiB | 47 | 8 |
| dlist.cpp | H A D | 05-Nov-2021 | 15.1 KiB | 470 | 385 |
| eigio.cpp | H A D | 05-Nov-2021 | 7.1 KiB | 219 | 157 |
| eigio.h | H A D | 05-Nov-2021 | 4.6 KiB | 103 | 36 |
| fitahx.cpp | H A D | 05-Nov-2021 | 4.8 KiB | 166 | 105 |
| fitahx.h | H A D | 05-Nov-2021 | 2 KiB | 47 | 5 |
| gmx_ana.h | H A D | 05-Nov-2021 | 4.6 KiB | 176 | 69 |
| gmx_anaeig.cpp | H A D | 05-Nov-2021 | 50.2 KiB | 1,503 | 1,340 |
| gmx_analyze.cpp | H A D | 05-Nov-2021 | 45.3 KiB | 1,371 | 1,211 |
| gmx_angle.cpp | H A D | 05-Nov-2021 | 17.1 KiB | 502 | 411 |
| gmx_awh.cpp | H A D | 05-Nov-2021 | 23.8 KiB | 633 | 415 |
| gmx_bar.cpp | H A D | 05-Nov-2021 | 114.5 KiB | 3,789 | 3,081 |
| gmx_bundle.cpp | H A D | 05-Nov-2021 | 14.8 KiB | 436 | 365 |
| gmx_chi.cpp | H A D | 05-Nov-2021 | 59 KiB | 1,636 | 1,426 |
| gmx_cluster.cpp | H A D | 05-Nov-2021 | 63.1 KiB | 2,041 | 1,778 |
| gmx_clustsize.cpp | H A D | 05-Nov-2021 | 20.2 KiB | 578 | 489 |
| gmx_confrms.cpp | H A D | 05-Nov-2021 | 25.9 KiB | 833 | 699 |
| gmx_covar.cpp | H A D | 05-Nov-2021 | 22.5 KiB | 705 | 592 |
| gmx_current.cpp | H A D | 05-Nov-2021 | 29.6 KiB | 1,033 | 802 |
| gmx_density.cpp | H A D | 05-Nov-2021 | 27.4 KiB | 793 | 625 |
| gmx_densmap.cpp | H A D | 05-Nov-2021 | 17.3 KiB | 531 | 465 |
| gmx_densorder.cpp | H A D | 05-Nov-2021 | 29.7 KiB | 863 | 658 |
| gmx_dielectric.cpp | H A D | 05-Nov-2021 | 14.5 KiB | 437 | 350 |
| gmx_dipoles.cpp | H A D | 05-Nov-2021 | 54.9 KiB | 1,714 | 1,454 |
| gmx_disre.cpp | H A D | 05-Nov-2021 | 31.1 KiB | 952 | 823 |
| gmx_do_dssp.cpp | H A D | 05-Nov-2021 | 24.2 KiB | 773 | 643 |
| gmx_dos.cpp | H A D | 05-Nov-2021 | 19.1 KiB | 601 | 480 |
| gmx_dyecoupl.cpp | H A D | 05-Nov-2021 | 16.3 KiB | 468 | 368 |
| gmx_enemat.cpp | H A D | 05-Nov-2021 | 21.6 KiB | 633 | 545 |
| gmx_energy.cpp | H A D | 05-Nov-2021 | 69 KiB | 2,150 | 1,849 |
| gmx_filter.cpp | H A D | 05-Nov-2021 | 11.8 KiB | 361 | 300 |
| gmx_gyrate.cpp | H A D | 05-Nov-2021 | 12.6 KiB | 413 | 346 |
| gmx_h2order.cpp | H A D | 05-Nov-2021 | 14.3 KiB | 367 | 263 |
| gmx_hbond.cpp | H A D | 05-Nov-2021 | 111.7 KiB | 3,521 | 3,021 |
| gmx_helix.cpp | H A D | 05-Nov-2021 | 12.1 KiB | 293 | 224 |
| gmx_helixorient.cpp | H A D | 05-Nov-2021 | 17.8 KiB | 485 | 377 |
| gmx_hydorder.cpp | H A D | 05-Nov-2021 | 24.6 KiB | 723 | 549 |
| gmx_lie.cpp | H A D | 05-Nov-2021 | 7.3 KiB | 227 | 166 |
| gmx_make_edi.cpp | H A D | 05-Nov-2021 | 41.3 KiB | 1,120 | 915 |
| gmx_mdmat.cpp | H A D | 05-Nov-2021 | 11.9 KiB | 408 | 332 |
| gmx_mindist.cpp | H A D | 05-Nov-2021 | 27.2 KiB | 876 | 770 |
| gmx_msd.cpp | H A D | 05-Nov-2021 | 39.9 KiB | 1,230 | 1,037 |
| gmx_nmeig.cpp | H A D | 05-Nov-2021 | 28.1 KiB | 812 | 644 |
| gmx_nmens.cpp | H A D | 05-Nov-2021 | 8.8 KiB | 271 | 201 |
| gmx_nmr.cpp | H A D | 05-Nov-2021 | 31.7 KiB | 933 | 798 |
| gmx_nmtraj.cpp | H A D | 05-Nov-2021 | 10.3 KiB | 311 | 208 |
| gmx_order.cpp | H A D | 05-Nov-2021 | 43.7 KiB | 1,182 | 932 |
| gmx_polystat.cpp | H A D | 05-Nov-2021 | 16.2 KiB | 517 | 427 |
| gmx_potential.cpp | H A D | 05-Nov-2021 | 19 KiB | 532 | 403 |
| gmx_principal.cpp | H A D | 05-Nov-2021 | 6.6 KiB | 180 | 114 |
| gmx_rama.cpp | H A D | 05-Nov-2021 | 4.2 KiB | 117 | 67 |
| gmx_rms.cpp | H A D | 05-Nov-2021 | 39.8 KiB | 1,196 | 1,069 |
| gmx_rmsdist.cpp | H A D | 05-Nov-2021 | 26.9 KiB | 897 | 740 |
| gmx_rmsf.cpp | H A D | 05-Nov-2021 | 18.8 KiB | 590 | 484 |
| gmx_rotacf.cpp | H A D | 05-Nov-2021 | 7.7 KiB | 239 | 169 |
| gmx_rotmat.cpp | H A D | 05-Nov-2021 | 10.6 KiB | 319 | 248 |
| gmx_saltbr.cpp | H A D | 05-Nov-2021 | 9.6 KiB | 307 | 244 |
| gmx_sans.cpp | H A D | 05-Nov-2021 | 13.9 KiB | 372 | 278 |
| gmx_saxs.cpp | H A D | 05-Nov-2021 | 3.7 KiB | 93 | 44 |
| gmx_sham.cpp | H A D | 05-Nov-2021 | 36.8 KiB | 1,110 | 948 |
| gmx_sigeps.cpp | H A D | 05-Nov-2021 | 7.2 KiB | 185 | 134 |
| gmx_sorient.cpp | H A D | 05-Nov-2021 | 16 KiB | 462 | 375 |
| gmx_spatial.cpp | H A D | 05-Nov-2021 | 17.8 KiB | 496 | 422 |
| gmx_spol.cpp | H A D | 05-Nov-2021 | 12.6 KiB | 386 | 302 |
| gmx_tcaf.cpp | H A D | 05-Nov-2021 | 18.3 KiB | 503 | 427 |
| gmx_traj.cpp | H A D | 05-Nov-2021 | 33.3 KiB | 1,158 | 1,039 |
| gmx_trjorder.cpp | H A D | 05-Nov-2021 | 12.4 KiB | 384 | 320 |
| gmx_vanhove.cpp | H A D | 05-Nov-2021 | 16.1 KiB | 488 | 414 |
| gmx_velacc.cpp | H A D | 05-Nov-2021 | 11.9 KiB | 362 | 269 |
| gmx_wham.cpp | H A D | 05-Nov-2021 | 133.6 KiB | 3,875 | 3,103 |
| gmx_wheel.cpp | H A D | 05-Nov-2021 | 8.7 KiB | 291 | 224 |
| gmx_xpm2ps.cpp | H A D | 05-Nov-2021 | 54 KiB | 1,643 | 1,469 |
| gstat.h | H A D | 05-Nov-2021 | 12 KiB | 318 | 154 |
| hxprops.cpp | H A D | 05-Nov-2021 | 15.6 KiB | 594 | 481 |
| hxprops.h | H A D | 05-Nov-2021 | 6 KiB | 189 | 87 |
| interf.h | H A D | 05-Nov-2021 | 2 KiB | 55 | 14 |
| nrama.cpp | H A D | 05-Nov-2021 | 6.9 KiB | 260 | 187 |
| nrama.h | H A D | 05-Nov-2021 | 2.8 KiB | 84 | 38 |
| nsfactor.cpp | H A D | 05-Nov-2021 | 13 KiB | 418 | 334 |
| nsfactor.h | H A D | 05-Nov-2021 | 4.4 KiB | 104 | 52 |
| powerspect.cpp | H A D | 05-Nov-2021 | 5 KiB | 141 | 79 |
| powerspect.h | H A D | 05-Nov-2021 | 2.5 KiB | 62 | 19 |
| pp2shift.cpp | H A D | 05-Nov-2021 | 7.3 KiB | 256 | 185 |
| princ.cpp | H A D | 05-Nov-2021 | 8.6 KiB | 326 | 255 |
| princ.h | H A D | 05-Nov-2021 | 3.2 KiB | 75 | 14 |
| sfactor.cpp | H A D | 05-Nov-2021 | 21.2 KiB | 742 | 537 |
| sfactor.h | H A D | 05-Nov-2021 | 4.5 KiB | 104 | 47 |
| thermochemistry.cpp | H A D | 05-Nov-2021 | 7.5 KiB | 204 | 152 |
| thermochemistry.h | H A D | 05-Nov-2021 | 6.1 KiB | 150 | 24 |