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../ GromacsWrapper-0.9.1 08-Feb-2026 02:48 3247 MDAnalysis-2.9.0 08-Feb-2026 02:48 5687 Manifest.gz 08-Feb-2026 02:48 11K ParmEd-4.3.0 08-Feb-2026 02:48 2057 autodock-4.2.6-r1 03-Feb-2026 23:51 929 autodock_vina-1.2.7 08-Feb-2026 02:48 574 avogadro2-1.101.0 08-Feb-2026 02:48 1301 avogadro2-1.102.1 08-Feb-2026 02:48 1307 bodr-10 17-Dec-2025 15:42 328 cara-bin-1.8.4-r2 19-Dec-2025 10:13 846 chemex-2025.10.0 08-Feb-2026 02:48 5570 chemex-2025.4.0 08-Feb-2026 02:48 5589 chemical-mime-data-0.1.95_pre20171122 03-Feb-2026 23:51 1143 chemtool-1.6.14-r1 03-Feb-2026 23:51 1162 clashlist-3.17-r1 19-Dec-2025 10:13 431 cluster-1.3.081231-r1 03-Feb-2026 23:51 425 cluster-1.3.081231-r2 03-Feb-2026 23:51 425 dssp-2.2.1-r3 03-Feb-2026 23:51 450 dssp-4.5.3 08-Feb-2026 02:48 925 dssp-4.5.5 08-Feb-2026 02:48 929 dssp-4.5.6 08-Feb-2026 02:48 921 easychem-0.6-r2 03-Feb-2026 23:51 576 elem-1.0.3-r3 03-Feb-2026 23:51 412 gelemental-2.0.0-r1 08-Feb-2026 02:48 1163 gelemental-2.0.2 08-Feb-2026 02:48 1171 gnome-chemistry-utils-0.14.17_p6-r4 08-Feb-2026 02:48 2041 gperiodic-3.0.3 03-Feb-2026 23:51 639 gperiodic-3.0.3-r1 03-Feb-2026 23:51 640 gromacs-2023.5 08-Feb-2026 02:48 3987 gromacs-2024.6 08-Feb-2026 02:48 3994 gromacs-2025.3 08-Feb-2026 02:48 4736 gromacs-2025.4 08-Feb-2026 02:48 4738 gromacs-2025.9999 08-Feb-2026 02:48 4581 gromacs-2026.0 08-Feb-2026 02:48 4791 gromacs-2026.9999 08-Feb-2026 02:48 4634 gromacs-9999 08-Feb-2026 02:48 4629 ksdssp-040728-r1 03-Feb-2026 23:51 449 mdtraj-1.10.3 08-Feb-2026 02:48 4713 moldy-2.16e-r2 08-Feb-2026 02:48 491 molmol-2k_p2-r10 08-Feb-2026 02:48 1297 molmol-2k_p2-r9 03-Feb-2026 23:51 1178 molsketch-0.8.3 08-Feb-2026 02:48 1161 molsketch-0.8.4 08-Feb-2026 02:48 1161 mpqc-2.3.1-r4 03-Feb-2026 23:51 1027 msms-bin-2.6.1-r1 19-Dec-2025 10:13 373 mustang-3.2.2 03-Feb-2026 23:51 410 openbabel-3.1.1_p20241221-r2 08-Feb-2026 02:48 2911 openbabel-3.1.1_p20241221-r4 08-Feb-2026 02:48 3261 openbabel-9999 08-Feb-2026 02:48 3195 pdbcat-1.3-r1 08-Feb-2026 02:48 748 pdbcns-2.0.010504 19-Dec-2025 10:13 360 pdbmat-3.89-r1 08-Feb-2026 02:48 846 probe-2.13.110909 03-Feb-2026 23:51 466 propka-3.5.1 08-Feb-2026 02:48 2006 psi-3.4.0-r3 08-Feb-2026 02:48 1167 pymol-3.1.0-r1 08-Feb-2026 02:48 4507 raster3d-3.0.6-r1 08-Feb-2026 02:48 835 suitename-0.3.070628 03-Feb-2026 23:51 459 surf-1.0 03-Feb-2026 23:51 391 theseus-3.3.0-r1 03-Feb-2026 23:51 735 threeV-1.2-r2 03-Feb-2026 23:51 357 tinker-8.2.1-r1 08-Feb-2026 02:48 1057 tm-align-20150914-r1 08-Feb-2026 02:48 858 vmd-1.9.4_alpha57-r4 08-Feb-2026 02:48 3025 votca-2022.1-r1 08-Feb-2026 02:48 1921 votca-9999 08-Feb-2026 02:48 1914 wxmacmolplt-7.7.2-r1 08-Feb-2026 02:48 1113 xds-bin-20240831 05-Jul-2024 14:12 463