Table 1 |
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|
General format of the fragment dictionary (AT = Atom Type, BT = Bond Type). |
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|
Type ID |
General Fragment Type |
Atom Count |
|
|
||
|
1) |
AT BT AT |
2 |
|
2) |
AT BT AT BT AT |
3 |
|
3) |
AT BT AT BT AT BT AT |
4 |
|
4) |
AT BT AT BT AT |
4 |
|
BT |
||
|
AT |
||
|
|
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|
Wong and Burkowski Journal of Cheminformatics 2009 1:4 doi:10.1186/1758-2946-1-4 |
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