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../ GromacsWrapper-0.9.1 23-Oct-2025 18:44 3247 MDAnalysis-2.9.0 23-Oct-2025 18:44 5700 Manifest.gz 04-Nov-2025 11:40 11K ParmEd-4.3.0 23-Oct-2025 18:44 2057 autodock-4.2.6-r1 12-Oct-2025 15:26 929 autodock_vina-1.1.2-r1 12-Oct-2025 15:26 523 autodock_vina-1.2.5 12-Oct-2025 15:26 574 avogadro2-1.101.0 04-Nov-2025 11:40 1325 avogadro2-1.102.1 04-Nov-2025 11:40 1331 bodr-10 30-Apr-2024 18:41 339 cara-bin-1.8.4-r2 08-Oct-2022 18:10 870 chemex-2024.09.25 23-Oct-2025 18:44 7800 chemex-2025.4.0 23-Oct-2025 18:44 5589 chemical-mime-data-0.1.95_pre20171122 12-Oct-2025 15:26 1143 chemtool-1.6.14-r1 12-Oct-2025 15:26 1162 clashlist-3.17-r1 09-Jun-2023 15:40 455 cluster-1.3.081231-r1 12-Oct-2025 15:26 449 cluster-1.3.081231-r2 12-Oct-2025 15:26 449 dssp-2.2.1-r3 12-Oct-2025 15:26 474 dssp-4.5.3 31-Oct-2025 23:41 925 dssp-4.5.5 31-Oct-2025 23:41 929 dssp-4.5.6 31-Oct-2025 23:41 922 easychem-0.6-r2 12-Oct-2025 15:26 600 elem-1.0.3-r3 12-Oct-2025 15:26 412 gelemental-2.0.0-r1 12-Oct-2025 15:26 1163 gelemental-2.0.2 12-Oct-2025 15:26 1171 gnome-chemistry-utils-0.14.17_p6-r4 12-Oct-2025 15:26 2041 gperiodic-3.0.3 12-Oct-2025 15:26 639 gperiodic-3.0.3-r1 12-Oct-2025 15:26 640 gromacs-2023.5 31-Oct-2025 23:41 4505 gromacs-2024.6 31-Oct-2025 23:41 4512 gromacs-2024.9999 31-Oct-2025 23:41 4333 gromacs-2025.3 31-Oct-2025 23:41 5582 gromacs-2025.9999 31-Oct-2025 23:41 5403 gromacs-9999 31-Oct-2025 23:41 5451 ksdssp-040728-r1 12-Oct-2025 15:26 473 mdtraj-1.10.3 23-Oct-2025 18:44 4726 moldy-2.16e-r2 12-Oct-2025 15:26 526 molmol-2k_p2-r10 04-Nov-2025 10:12 1321 molmol-2k_p2-r9 04-Nov-2025 10:12 1202 molsketch-0.8.3 31-Oct-2025 23:41 1185 molsketch-0.8.4 31-Oct-2025 23:41 1185 mpqc-2.3.1-r4 12-Oct-2025 15:26 1027 msms-bin-2.6.1-r1 19-Oct-2023 15:10 397 mustang-3.2.2 12-Oct-2025 15:26 434 openbabel-3.1.1_p20210225-r3 04-Nov-2025 09:18 2544 openbabel-3.1.1_p20241221-r2 04-Nov-2025 09:18 2946 openbabel-3.1.1_p20241221-r3 04-Nov-2025 09:18 3297 openbabel-9999 04-Nov-2025 09:18 3195 pdbcat-1.3-r1 31-Oct-2025 23:41 772 pdbcns-2.0.010504 16-Sep-2020 20:39 384 pdbmat-3.89-r1 31-Oct-2025 23:41 870 probe-2.13.110909 12-Oct-2025 15:26 490 propka-3.5.1 23-Oct-2025 18:44 2030 psi-3.4.0-r3 12-Oct-2025 15:26 1121 pymol-3.1.0-r1 04-Nov-2025 10:12 4531 raster3d-3.0.6-r1 12-Oct-2025 15:26 859 suitename-0.3.070628 12-Oct-2025 15:26 483 surf-1.0 12-Oct-2025 15:26 415 theseus-3.3.0-r1 12-Oct-2025 15:26 759 threeV-1.2-r2 12-Oct-2025 15:26 381 tinker-8.2.1-r1 12-Oct-2025 15:26 1081 tm-align-20150914-r1 31-Oct-2025 23:41 882 vmd-1.9.4_alpha57-r4 23-Oct-2025 18:44 3049 votca-2022.1-r1 31-Oct-2025 23:41 1934 votca-9999 31-Oct-2025 23:41 1914 wxmacmolplt-7.7.2-r1 12-Oct-2025 15:26 1113 xds-bin-20240831 05-Jul-2024 14:12 463