Table 3.
compound | score | crash | polar |
---|---|---|---|
1 | 6.24 | −0.96 | 1.14 |
2 | 4.37 | −2.52 | 0.00 |
3 | 4.60 | −3.38 | 0.02 |
4 | 5.93 | −2.80 | 0.01 |
5 | 6.12 | −1.54 | 0.01 |
6 | 3.89 | −2.97 | 2.46 |
Using SYBYL 7.3.4, SurFlex-Dock 2.1.
compound | score | crash | polar |
---|---|---|---|
1 | 6.24 | −0.96 | 1.14 |
2 | 4.37 | −2.52 | 0.00 |
3 | 4.60 | −3.38 | 0.02 |
4 | 5.93 | −2.80 | 0.01 |
5 | 6.12 | −1.54 | 0.01 |
6 | 3.89 | −2.97 | 2.46 |
Using SYBYL 7.3.4, SurFlex-Dock 2.1.