Full input and output files for computationally docked structures of congeneric ligands similar to BDBM24643=LZ8 in crystal structure 2VTO

1. BindingDB_24654.docklog.results_tab.log
2. 2VTO-voxthresh-9.pdb
3. 2VTO_congener-log.txt
4. prot-log.txt
5. BindingDB_24643.docklog.results_tab.log
6. BindingDB_24645.frags.mol2
7. 2VTO-results_BindingDB_24644.mol2
8. 2VTO-voxthresh-6.pdb
9. 2VTO-voxthresh-4.pdb
10. BindingDB_24642.mol2
11. 2VTO-results_BindingDB_24640.mol2
12. 2VTO-protomol.mol2
13. BindingDB_24639.mol2
14. BindingDB_24644.docklog.results_tab.log
15. BindingDB_24647.docklog.results_tab.log
16. 2VTO.pdb
17. BindingDB_24642.frags.mol2
18. BindingDB_24646.mol2
19. BindingDB_24649.docklog.results_tab.log
20. BindingDB_24644.docklog.mol2
21. 2VTO-voxthresh-5.pdb
22. BindingDB_24654.mol2
23. BindingDB_24641.mol2
24. BindingDB_24648.frags.mol2
25. 2VTO-results_BindingDB_24643.mol2
26. BindingDB_24643.docklog
27. bdb_2VTO_LZ8_sim.txt
28. BindingDB_24647.docklog.mol2
29. 2VTO-results_BindingDB_24647.mol2
30. BindingDB_24649.docklog.mol2
31. 2VTO_sdf.mol2
32. bdb_2VTO_LZ8_3D.sdf
33. BindingDB_24645.docklog.results_tab.log
34. log-results.mol2
35. BindingDB_24640.frags.mol2
36. 2VTO-marked-protein.pdb
37. BindingDB_24648.docklog.mol2
38. 2VTO-results_BindingDB_24646.mol2
39. 2VTO_sdf-log.txt
40. 2VTO_congener.mol2
41. BindingDB_24649.mol2
42. BindingDB_24642.docklog.mol2
43. BindingDB_24641.frags.mol2
44. BindingDB_24651.docklog.mol2
45. BindingDB_24642.docklog.results_tab.log
46. BindingDB_24640.docklog.results_tab.log
47. BindingDB_24651.frags.mol2
48. BindingDB_24646.docklog.mol2
49. log-results_tab.log
50. BindingDB_24649.frags.mol2
51. BindingDB_24639.docklog.mol2
52. BindingDB_24645.mol2
53. 2VTO.mol2
54. 2VTO-results_BindingDB_24648.mol2
55. BindingDB_24641.docklog.results_tab.log
56. BindingDB_24645.docklog.mol2
57. BindingDB_24649.docklog
58. 2VTO-results_BindingDB_24642.mol2
59. BindingDB_24639.docklog
60. BindingDB_24654.docklog.mol2
61. BindingDB_24641.docklog.mol2
62. 2VTO_ligand0.mol2
63. 2VTO-voxthresh-3.pdb
64. BindingDB_24651.mol2
65. BindingDB_24639.docklog.results_tab.log
66. log
67. 2VTO-voxthresh-10.pdb
68. 2VTO-voxthresh-7.pdb
69. BindingDB_24640.docklog
70. BindingDB_24643.frags.mol2
71. BindingDB_24650.docklog.results_tab.log
72. BindingDB_24647.docklog
73. BindingDB_24648.mol2
74. 2VTO-results_BindingDB_24638.mol2
75. BindingDB_24638.docklog
76. BindingDB_24644.docklog
77. BindingDB_24638.docklog.mol2
78. 2VTO-voxthresh-1.pdb
79. 2VTO-results_BindingDB_24639.mol2
80. 2VTO.csv
81. BindingDB_24647.mol2
82. scale
83. BindingDB_24651.docklog.results_tab.log
84. BindingDB_24643.mol2
85. frag2.mol2
86. 2VTO-results.mol2
87. BindingDB_24648.docklog.results_tab.log
88. prot.mol2
89. LZ8.sdf
90. BindingDB_24640.mol2
91. BindingDB_24642.docklog
92. BindingDB_24650.mol2
93. BindingDB_24638.frags.mol2
94. BindingDB_24647.frags.mol2
95. 2VTO_water.mol2
96. BindingDB_24651.docklog
97. BindingDB_24641.docklog
98. BindingDB_24639.frags.mol2
99. 2VTO-results_BindingDB_24641.mol2
100. 2VTO-results_BindingDB_24651.mol2
101. BindingDB_24645.docklog
102. BindingDB_24646.docklog
103. BindingDB_24646.frags.mol2
104. BindingDB_24640.docklog.mol2
105. 2VTO-voxthresh-0.pdb
106. BindingDB_24646.docklog.results_tab.log
107. 2VTO-results_tab.log
108. BindingDB_24643.docklog.mol2
109. BindingDB_24648.docklog
110. BindingDB_24650.docklog
111. 2VTO.opt-protein-trim.mol2
112. BindingDB_24638.mol2
113. BindingDB_24650.frags.mol2
114. 2VTO-results_BindingDB_24645.mol2
115. 2VTO-results_BindingDB_24650.mol2
116. 2VTO.Targets
117. BindingDB_24654.docklog
118. BindingDB_24650.docklog.mol2
119. BindingDB_24644.frags.mol2
120. 2VTO-marked-vox.pdb
121. 2VTO-voxthresh-8.pdb
122. frag1.mol2
123. 2VTO-voxthresh-2.pdb
124. BindingDB_24644.mol2
125. 2VTO-results_BindingDB_24649.mol2
126. BindingDB_24654.frags.mol2
127. BindingDB_24638.docklog.results_tab.log