Full input and output files for computationally docked structures of congeneric ligands similar to BDBM13465=IZD in crystal structure 2CM7

1. 2CM7-marked-protein.pdb
2. 2CM7-results_BindingDB_13811.mol2
3. BindingDB_13489.mol2
4. BindingDB_13808.mol2
5. 2CM7_water.mol2
6. prot-log.txt
7. BindingDB_13491.docklog.mol2
8. BindingDB_13807.docklog
9. BindingDB_50189641.frags.mol2
10. BindingDB_50189674.docklog.mol2
11. BindingDB_13809.mol2
12. BindingDB_50341990.frags.mol2
13. 2CM7-voxthresh-3.pdb
14. BindingDB_13491.docklog
15. BindingDB_50189674.mol2
16. 2CM7.csv
17. BindingDB_13465.frags.mol2
18. 2CM7-voxthresh-8.pdb
19. BindingDB_50189641.docklog
20. BindingDB_13811.docklog
21. bdb_2CM7_IZD_3D.sdf
22. BindingDB_13812.docklog.mol2
23. 2CM7_sdf.mol2
24. BindingDB_13811.mol2
25. IZD.sdf
26. BindingDB_13808.docklog.results_tab.log
27. BindingDB_13808.frags.mol2
28. BindingDB_13465.docklog.mol2
29. BindingDB_50228011.docklog.mol2
30. 2CM7-results_tab.log
31. BindingDB_13492.frags.mol2
32. BindingDB_13808.docklog.mol2
33. BindingDB_13489.frags.mol2
34. BindingDB_13811.docklog.results_tab.log
35. 2CM7.opt-protein-trim.mol2
36. log-results.mol2
37. 2CM7-results_BindingDB_13808.mol2
38. BindingDB_13812.mol2
39. BindingDB_50189674.docklog.results_tab.log
40. BindingDB_13807.docklog.mol2
41. BindingDB_50189641.mol2
42. 2CM7-results_BindingDB_13491.mol2
43. BindingDB_13490.mol2
44. BindingDB_13488.docklog.results_tab.log
45. BindingDB_13490.docklog.results_tab.log
46. BindingDB_13808.docklog
47. BindingDB_13492.docklog
48. 2CM7-results_BindingDB_13812.mol2
49. BindingDB_13812.docklog.results_tab.log
50. BindingDB_13809.docklog.mol2
51. BindingDB_14268.frags.mol2
52. 2CM7-voxthresh-10.pdb
53. log-results_tab.log
54. 2CM7_sdf-log.txt
55. BindingDB_13465.mol2
56. 2CM7-voxthresh-1.pdb
57. protein_sampling.mol2
58. BindingDB_50189674.frags.mol2
59. BindingDB_13488.mol2
60. BindingDB_13809.docklog
61. BindingDB_13491.mol2
62. 2CM7-results_BindingDB_13489.mol2
63. BindingDB_50341990.docklog.mol2
64. BindingDB_50189641.docklog.mol2
65. BindingDB_13488.docklog.mol2
66. BindingDB_13465.docklog
67. 2CM7-voxthresh-7.pdb
68. BindingDB_50341990.mol2
69. 2CM7_congener-log.txt
70. BindingDB_14268.docklog
71. BindingDB_14268.mol2
72. BindingDB_13807.mol2
73. BindingDB_50341990.docklog.results_tab.log
74. 2CM7-marked-vox.pdb
75. BindingDB_13492.mol2
76. log
77. 2CM7-results_BindingDB_13809.mol2
78. 2CM7-voxthresh-9.pdb
79. BindingDB_13489.docklog
80. ligand_sampling.mol2
81. 2CM7-results_BindingDB_13807.mol2
82. bdb_2CM7_IZD_sim.txt
83. BindingDB_13490.docklog
84. 2CM7.pdb
85. BindingDB_13489.docklog.results_tab.log
86. BindingDB_13809.frags.mol2
87. BindingDB_13465.docklog.results_tab.log
88. BindingDB_13812.frags.mol2
89. BindingDB_13809.docklog.results_tab.log
90. 2CM7-results_BindingDB_13492.mol2
91. BindingDB_13807.docklog.results_tab.log
92. 2CM7-results_BindingDB_50228011.mol2
93. 2CM7-results_BindingDB_50189674.mol2
94. BindingDB_13488.frags.mol2
95. BindingDB_13489.docklog.mol2
96. scale
97. BindingDB_50228011.docklog
98. BindingDB_13811.docklog.mol2
99. frag2.mol2
100. 2CM7-results_BindingDB_13465.mol2
101. BindingDB_13812.docklog
102. prot.mol2
103. BindingDB_13491.frags.mol2
104. BindingDB_13491.docklog.results_tab.log
105. BindingDB_13807.frags.mol2
106. 2CM7_congener.mol2
107. 2CM7-voxthresh-4.pdb
108. 2CM7-voxthresh-0.pdb
109. BindingDB_14268.docklog.results_tab.log
110. BindingDB_50189674.docklog
111. BindingDB_50228011.docklog.results_tab.log
112. 2CM7_ligand0.mol2
113. 2CM7-results_BindingDB_14268.mol2
114. BindingDB_13488.docklog
115. BindingDB_13490.frags.mol2
116. BindingDB_50228011.frags.mol2
117. 2CM7-results.mol2
118. 2CM7-protomol.mol2
119. BindingDB_50189641.docklog.results_tab.log
120. 2CM7-results_BindingDB_13488.mol2
121. 2CM7-voxthresh-2.pdb
122. BindingDB_13490.docklog.mol2
123. BindingDB_13492.docklog.mol2
124. BindingDB_13811.frags.mol2
125. BindingDB_14268.docklog.mol2
126. BindingDB_50341990.docklog
127. 2CM7-voxthresh-6.pdb
128. BindingDB_50228011.mol2
129. 2CM7.mol2
130. frag1.mol2
131. 2CM7-voxthresh-5.pdb
132. BindingDB_13492.docklog.results_tab.log
133. 2CM7.Targets