All tasks for computer 9078


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State: All (2574) · In progress (45) · Validation pending (0) · Validation inconclusive (0) · Valid (2527) · Invalid (0) · Error (2)
Application: All (2574) · gromacs (0) · Gromacs_v2 (0) · smina_mol2 (2574) · smina_pdbqt (0) · smina_sdf (0) · vina (0)
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smina-mol2_SM002c_config-4n4v_zinc15-00012_BDABRN.xaa-ligand-3870.pdbqt_37468_52586.in_1 23209178 17 Dec 2017, 1:25:50 UTC 18 Dec 2017, 0:37:55 UTC Error while computing 2.15 0.00 --- smina_mol2 v0.09
x86_64-pc-linux-gnu
smina-mol2_SM002c_config-4n4v_zinc15-00012_BDABRN.xaa-ligand-8888.pdbqt_42486_52586.in_0 23219197 17 Dec 2017, 0:44:39 UTC 18 Dec 2017, 0:37:55 UTC Completed and validated 79.08 75.43 1.57 smina_mol2 v0.09
x86_64-pc-linux-gnu
smina-mol2_SM002c_config-4n4v_zinc15-00012_BDABRN.xaa-ligand-8891.pdbqt_42489_52586.in_0 23219203 17 Dec 2017, 0:44:39 UTC 18 Dec 2017, 0:37:55 UTC Completed and validated 152.90 149.22 3.03 smina_mol2 v0.09
x86_64-pc-linux-gnu
smina-mol2_SM002c_config-4n4v_zinc15-00012_BDABRN.xaa-ligand-8892.pdbqt_42490_52586.in_0 23219205 17 Dec 2017, 0:44:39 UTC 18 Dec 2017, 0:49:56 UTC Completed and validated 88.80 85.42 1.50 smina_mol2 v0.09
x86_64-pc-linux-gnu
smina-mol2_SM002c_config-4n4v_zinc15-00012_BDABRN.xaa-ligand-8893.pdbqt_42491_52586.in_0 23219207 17 Dec 2017, 0:44:39 UTC 18 Dec 2017, 0:37:55 UTC Completed and validated 88.68 85.43 1.74 smina_mol2 v0.09
x86_64-pc-linux-gnu
smina-mol2_SM002c_config-4n4v_zinc15-00012_BDABRN.xaa-ligand-8895.pdbqt_42493_52586.in_0 23219211 17 Dec 2017, 0:44:39 UTC 18 Dec 2017, 0:49:56 UTC Completed and validated 91.87 84.72 1.55 smina_mol2 v0.09
x86_64-pc-linux-gnu
smina-mol2_SM002c_config-4n4v_zinc15-00012_BDABRN.xaa-ligand-8896.pdbqt_42494_52586.in_0 23219213 17 Dec 2017, 0:44:39 UTC 18 Dec 2017, 0:49:56 UTC Completed and validated 80.49 77.29 1.36 smina_mol2 v0.09
x86_64-pc-linux-gnu
smina-mol2_SM002c_config-4n4v_zinc15-00012_BDABRN.xaa-ligand-9062.pdbqt_42660_52586.in_0 23219545 17 Dec 2017, 0:45:46 UTC 18 Dec 2017, 0:50:10 UTC Completed and validated 57.46 54.31 0.96 smina_mol2 v0.09
x86_64-pc-linux-gnu
smina-mol2_SM002c_config-4n4v_zinc15-00012_BDABRN.xaa-ligand-9063.pdbqt_42661_52586.in_0 23219547 17 Dec 2017, 0:45:46 UTC 18 Dec 2017, 0:37:55 UTC Completed and validated 144.80 141.45 2.85 smina_mol2 v0.09
x86_64-pc-linux-gnu
smina-mol2_SM002c_config-4n4v_zinc15-00012_BDABRN.xaa-ligand-9064.pdbqt_42662_52586.in_0 23219549 17 Dec 2017, 0:45:46 UTC 18 Dec 2017, 0:37:55 UTC Completed and validated 111.37 107.79 2.17 smina_mol2 v0.09
x86_64-pc-linux-gnu
smina-mol2_SM002c_config-4n4v_zinc15-00012_BDABRN.xaa-ligand-9065.pdbqt_42663_52586.in_0 23219551 17 Dec 2017, 0:45:46 UTC 18 Dec 2017, 0:37:55 UTC Completed and validated 134.73 132.12 2.62 smina_mol2 v0.09
x86_64-pc-linux-gnu
smina-mol2_SM002c_config-4n4v_zinc15-00012_BDABRN.xaa-ligand-9305.pdbqt_42903_52586.in_0 23220032 17 Dec 2017, 0:47:07 UTC 18 Dec 2017, 0:37:55 UTC Completed and validated 93.76 91.74 1.81 smina_mol2 v0.09
x86_64-pc-linux-gnu
smina-mol2_SM002c_config-4n4v_zinc15-00012_BDABRN.xaa-ligand-9306.pdbqt_42904_52586.in_0 23220034 17 Dec 2017, 0:47:07 UTC 18 Dec 2017, 0:37:55 UTC Completed and validated 28.81 25.37 0.56 smina_mol2 v0.09
x86_64-pc-linux-gnu
smina-mol2_SM002c_config-4n4v_zinc15-00012_BDABRN.xaa-ligand-9361.pdbqt_42959_52586.in_0 23220143 17 Dec 2017, 0:47:32 UTC 18 Dec 2017, 0:37:55 UTC Completed and validated 86.43 83.76 1.68 smina_mol2 v0.09
x86_64-pc-linux-gnu
smina-mol2_SM002c_config-4n4v_zinc15-00012_BDABRN.xaa-ligand-9366.pdbqt_42964_52586.in_0 23220153 17 Dec 2017, 0:47:32 UTC 18 Dec 2017, 0:37:55 UTC Completed and validated 69.22 59.25 1.35 smina_mol2 v0.09
x86_64-pc-linux-gnu
smina-mol2_SM002c_config-4n4v_zinc15-00012_BDABRN.xaa-ligand-9367.pdbqt_42965_52586.in_0 23220155 17 Dec 2017, 0:47:32 UTC 18 Dec 2017, 0:37:55 UTC Completed and validated 85.39 82.55 1.66 smina_mol2 v0.09
x86_64-pc-linux-gnu
smina-mol2_SM002c_config-4n4v_zinc15-00012_BDABRN.xaa-ligand-9368.pdbqt_42966_52586.in_0 23220157 17 Dec 2017, 0:47:32 UTC 18 Dec 2017, 0:37:55 UTC Completed and validated 46.48 44.21 0.91 smina_mol2 v0.09
x86_64-pc-linux-gnu
smina-mol2_SM002c_config-4n4v_zinc15-00012_BDABRN.xaa-ligand-9369.pdbqt_42967_52586.in_0 23220159 17 Dec 2017, 0:47:32 UTC 18 Dec 2017, 0:37:55 UTC Completed and validated 27.26 25.54 0.53 smina_mol2 v0.09
x86_64-pc-linux-gnu
smina-mol2_SM002c_config-4n4v_zinc15-00012_BDABRN.xaa-ligand-9370.pdbqt_42968_52586.in_0 23220161 17 Dec 2017, 0:47:32 UTC 18 Dec 2017, 0:37:55 UTC Completed and validated 95.88 93.11 1.89 smina_mol2 v0.09
x86_64-pc-linux-gnu
smina-mol2_SM002c_config-4n4v_zinc15-00012_BDABRN.xaa-ligand-9371.pdbqt_42969_52586.in_0 23220163 17 Dec 2017, 0:47:32 UTC 18 Dec 2017, 0:37:55 UTC Completed and validated 63.87 60.14 1.26 smina_mol2 v0.09
x86_64-pc-linux-gnu
smina-mol2_SM002c_config-4n4v_zinc15-00012_BDABRN.xaa-ligand-9372.pdbqt_42970_52586.in_0 23220165 17 Dec 2017, 0:47:32 UTC 18 Dec 2017, 0:37:55 UTC Completed and validated 44.33 40.26 0.87 smina_mol2 v0.09
x86_64-pc-linux-gnu

Next 20
State: All (2574) · In progress (45) · Validation pending (0) · Validation inconclusive (0) · Valid (2527) · Invalid (0) · Error (2)
Application: All (2574) · gromacs (0) · Gromacs_v2 (0) · smina_mol2 (2574) · smina_pdbqt (0) · smina_sdf (0) · vina (0)
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