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81 to 90 of 11,355 Results
compound_10d_best.mol2
Nov 28, 2025 - Coordinate files and representative results for docking of HDACs with phorbazole analogues
Unknown - 2.7 KB - MD5: 1a4d76a466f704df5c6fd6f50fe810fb
compound_10e_1_best.mol2
Nov 28, 2025 - Coordinate files and representative results for docking of HDACs with phorbazole analogues
Unknown - 2.7 KB - MD5: a542acc5e6f5515a9e11c82d6586e9fb
compound_10e_2_best.mol2
Nov 28, 2025 - Coordinate files and representative results for docking of HDACs with phorbazole analogues
Unknown - 2.7 KB - MD5: a06f4e46958100c3a1504691ae44c772
compound_10f_1_best.mol2
Nov 28, 2025 - Coordinate files and representative results for docking of HDACs with phorbazole analogues
Unknown - 2.3 KB - MD5: 4ddd227fcd10b4596afda62e50f0da7f
compound_10f_2_best.mol2
Nov 28, 2025 - Coordinate files and representative results for docking of HDACs with phorbazole analogues
Unknown - 2.3 KB - MD5: 8fd7966ae39f6e487fe1afd67a5dd7da
compound_10g_1_best.mol2
Nov 28, 2025 - Coordinate files and representative results for docking of HDACs with phorbazole analogues
Unknown - 2.7 KB - MD5: 46262c89a02d0a1c66088212193d4f92
compound_10g_2_best.mol2
Nov 28, 2025 - Coordinate files and representative results for docking of HDACs with phorbazole analogues
Unknown - 2.7 KB - MD5: 4903c46ed9d703c2e94fed329b7e6632
HDAC_classI_dockingresults.pse
Nov 28, 2025 - Coordinate files and representative results for docking of HDACs with phorbazole analogues
Unknown - 14.8 MB - MD5: 54d6b14ac372a7180d1bda2af66763c9
Molecular dynamic trajectories for HDAC9 binding analysis
Nov 28, 2025
Guillaume Axel Petit, 2025, "Molecular dynamic trajectories for HDAC9 binding analysis", https://doi.org/10.18710/WUJCYB, DataverseNO, V1
This data consist in the models, topology files, parameters files and trajectories of molecular dynamics simulations of the catalytic domain of human HDAC9 and small molecule inhibitor "4-(2-(1H-pyrrol-2-yl)oxazol-5-yl) aniline", also known as compound 9 from publication: "Investigation of the histone deacetylase inhibitor potential of phorbazole a...
00_README.txt
Nov 28, 2025 - Molecular dynamic trajectories for HDAC9 binding analysis
Plain Text - 12.1 KB - MD5: 3dd0c584b084d53b040a7df918039455
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