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. Author manuscript; available in PMC: 2010 Aug 31.
Published in final edited form as: J Nat Prod. 2008 Feb 26;71(3):396–402. doi: 10.1021/np070587w

Table 3.

Virtual Binding Affinity of Compounds 1–6 for Rabbit Muscle α-Actin Complex.a

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
a

Using SYBYL 7.3.4, SurFlex-Dock 2.1.