Full input and output files for computationally docked structures of congeneric ligands similar to BDBM24631=LZ4 in crystal structure 2VTJ

1. 2VTJ-voxthresh-0.pdb
2. 2VTJ.csv
3. prot-log.txt
4. 2VTJ-voxthresh-1.pdb
5. BindingDB_24630.mol2
6. 2VTJ_congener.mol2
7. 2VTJ-voxthresh-3.pdb
8. BindingDB_24631.docklog.results_tab.log
9. BindingDB_24631.docklog
10. 2VTJ-voxthresh-7.pdb
11. BindingDB_24630.docklog.results_tab.log
12. 2VTJ_sdf.mol2
13. 2VTJ_ligand1.mol2
14. BindingDB_24631.frags.mol2
15. 2VTJ_sdf-log.txt
16. 2VTJ-voxthresh-8.pdb
17. 2VTJ-voxthresh-9.pdb
18. 2VTJ-voxthresh-6.pdb
19. log-results.mol2
20. 2VTJ-voxthresh-4.pdb
21. BindingDB_24630.frags.mol2
22. 2VTJ_ligand0.mol2
23. 2VTJ.pdb
24. 2VTJ-results.mol2
25. 2VTJ.mol2
26. log-results_tab.log
27. 2VTJ-voxthresh-2.pdb
28. LZ4.sdf
29. log
30. 2VTJ.opt-protein-trim.mol2
31. 2VTJ-voxthresh-5.pdb
32. 2VTJ-marked-protein.pdb
33. BindingDB_24630.docklog
34. 2VTJ_water.mol2
35. scale
36. frag2.mol2
37. prot.mol2
38. bdb_2VTJ_LZ4_sim.txt
39. 2VTJ-protomol.mol2
40. bdb_2VTJ_LZ4_3D.sdf
41. BindingDB_24631.mol2
42. 2VTJ_congener-log.txt
43. 2VTJ-results_tab.log
44. 2VTJ-results_BindingDB_24631.mol2
45. 2VTJ-marked-vox.pdb
46. 2VTJ.Targets
47. BindingDB_24630.docklog.mol2
48. frag1.mol2
49. BindingDB_24631.docklog.mol2
50. 2VTJ-results_BindingDB_24630.mol2