molecular-optimization/significant_cols.csv at master · wwydmanski/molecular-optimization · GitHub

1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
42
43
44
45
46
47
48
49
50
51
52
53
54
55
56
57
58
59
60
61
62
63
64
65
66
67
68
69
70
71
72
73
74
75
76
77
78
79
80
0
A54_contact
A54_backbone
A54_sidechain
A54_acceptor
A55_contact
A55_backbone
A55_sidechain
A55_acceptor
A75_contact
A114_contact
A117_contact
A117_backbone
A120_contact
A123_backbone
A123_sidechain
A124_contact
A124_backbone
A124_acceptor
A127_contact
A127_donor
A128_contact
A128_backbone
A128_sidechain
A133_contact
A140_contact
A143_contact
A143_backbone
A143_sidechain
A144_contact
A144_backbone
A144_sidechain
A147_contact
A147_backbone
A147_sidechain
A147_acceptor
A148_contact
A148_sidechain
A148_donor
A151_contact
A151_backbone
A151_sidechain
A154_contact
A155_contact
A217_contact
A217_backbone
A217_sidechain
A221_contact
A229_contact
A229_backbone
A229_sidechain
A232_contact
A232_sidechain
A233_contact
A233_backbone
A233_sidechain
A233_acceptor
A233_donor
A236_contact
A237_contact
A237_backbone
A293_contact
A296_contact
A296_sidechain
A297_contact
A300_contact
A303_contact
A318_contact
A319_contact
A322_contact
A322_backbone
A322_acceptor
A325_contact
A325_acceptor
A326_contact
A326_backbone
A326_donor
A328_contact
A329_contact
A329_backbone