Full input and output files for computationally docked structures of congeneric ligands similar to BDBM50207861=MUH in crystal structure 2OSC

1. 2OSC-voxthresh-4.pdb
2. bdb_2OSC_MUH_sim.txt
3. BindingDB_35327.frags.mol2
4. 2OSC-voxthresh-8.pdb
5. BindingDB_14975.docklog.results_tab.log
6. BindingDB_14974.docklog.results_tab.log
7. BindingDB_35320.mol2
8. prot-log.txt
9. BindingDB_35318.frags.mol2
10. BindingDB_14972.docklog.mol2
11. BindingDB_14973.mol2
12. 2OSC-results_BindingDB_35318.mol2
13. 2OSC-voxthresh-0.pdb
14. 2OSC-results.mol2
15. BindingDB_14975.docklog.mol2
16. BindingDB_35322.mol2
17. BindingDB_50237710.docklog.results_tab.log
18. 2OSC-voxthresh-6.pdb
19. BindingDB_35320.docklog
20. BindingDB_35318.mol2
21. 2OSC-voxthresh-9.pdb
22. BindingDB_50207861.mol2
23. 2OSC-voxthresh-3.pdb
24. BindingDB_14976.docklog.results_tab.log
25. 2OSC-voxthresh-7.pdb
26. BindingDB_13530.mol2
27. BindingDB_13530.docklog.results_tab.log
28. BindingDB_14975.frags.mol2
29. BindingDB_35321.docklog.mol2
30. BindingDB_35321.frags.mol2
31. BindingDB_35319.mol2
32. 2OSC-marked-protein.pdb
33. 2OSC_ligand0.mol2
34. BindingDB_14971.mol2
35. BindingDB_35322.docklog
36. BindingDB_14974.docklog.mol2
37. BindingDB_35319.docklog.mol2
38. log-results.mol2
39. BindingDB_50237710.frags.mol2
40. BindingDB_13530.docklog.mol2
41. BindingDB_15020.frags.mol2
42. BindingDB_14973.docklog
43. BindingDB_15020.docklog.mol2
44. BindingDB_14975.mol2
45. BindingDB_14976.frags.mol2
46. BindingDB_14976.mol2
47. BindingDB_50207861.docklog.mol2
48. BindingDB_15020.docklog.results_tab.log
49. BindingDB_14974.mol2
50. BindingDB_35320.docklog.results_tab.log
51. 2OSC.mol2
52. 2OSC-results_BindingDB_14976.mol2
53. BindingDB_14971.docklog.results_tab.log
54. 2OSC-voxthresh-10.pdb
55. 2OSC-results_BindingDB_14973.mol2
56. log-results_tab.log
57. BindingDB_14972.frags.mol2
58. BindingDB_13530.docklog
59. BindingDB_14976.docklog
60. 2OSC_congener-log.txt
61. BindingDB_50207861.docklog.results_tab.log
62. BindingDB_35320.docklog.mol2
63. BindingDB_50237710.mol2
64. BindingDB_35327.docklog
65. protein_sampling.mol2
66. 2OSC-results_BindingDB_15020.mol2
67. 2OSC.pdb
68. BindingDB_13530.frags.mol2
69. BindingDB_14974.docklog
70. 2OSC-voxthresh-2.pdb
71. 2OSC-results_BindingDB_35322.mol2
72. 2OSC.csv
73. BindingDB_14972.docklog.results_tab.log
74. log
75. BindingDB_35321.docklog.results_tab.log
76. 2OSC-voxthresh-1.pdb
77. BindingDB_14972.docklog
78. BindingDB_35322.docklog.results_tab.log
79. BindingDB_14975.docklog
80. BindingDB_35322.frags.mol2
81. bdb_2OSC_MUH_3D.sdf
82. 2OSC_sdf-log.txt
83. BindingDB_14972.mol2
84. 2OSC-results_tab.log
85. BindingDB_14971.docklog.mol2
86. 2OSC.Targets
87. 2OSC-results_BindingDB_14974.mol2
88. BindingDB_35319.frags.mol2
89. BindingDB_14971.docklog
90. BindingDB_35318.docklog
91. BindingDB_50207861.frags.mol2
92. scale
93. frag2.mol2
94. BindingDB_14973.docklog.results_tab.log
95. prot.mol2
96. BindingDB_35321.mol2
97. 2OSC-results_BindingDB_35321.mol2
98. 2OSC_sdf.mol2
99. 2OSC-results_BindingDB_50207861.mol2
100. BindingDB_35327.docklog.results_tab.log
101. 2OSC-voxthresh-5.pdb
102. BindingDB_50207861.docklog
103. 2OSC.opt-protein-trim.mol2
104. 2OSC-results_BindingDB_14971.mol2
105. UnDockable.list
106. BindingDB_35327.docklog.mol2
107. BindingDB_14973.docklog.mol2
108. BindingDB_35321.docklog
109. BindingDB_50237710.docklog
110. 2OSC_congener.mol2
111. BindingDB_35319.docklog
112. BindingDB_35318.docklog.results_tab.log
113. BindingDB_14971.frags.mol2
114. 2OSC-results_BindingDB_14975.mol2
115. 2OSC-protomol.mol2
116. BindingDB_14973.frags.mol2
117. BindingDB_35319.docklog.results_tab.log
118. 2OSC_water.mol2
119. BindingDB_15020.docklog
120. MUH.sdf
121. BindingDB_35327.mol2
122. BindingDB_35318.docklog.mol2
123. BindingDB_35320.frags.mol2
124. frag1.mol2
125. BindingDB_50237710.docklog.mol2
126. 2OSC-results_BindingDB_13530.mol2
127. BindingDB_14976.docklog.mol2
128. BindingDB_35322.docklog.mol2
129. BindingDB_15020.mol2
130. BindingDB_14974.frags.mol2
131. 2OSC-marked-vox.pdb