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. 2014 Jan 28;54(2):601–612. doi: 10.1021/ci400707h

Table 3. Best Energy Score for Docking of Drugs into Specified Homology Models Using GOLD and Scoring Docking Poses with ChemPLP.

  ChemPLP
drug MthK(1LNQ) 3F5W 3F7V
S-bupivacaine 73.3 56.8 11.2
cavalli-2 90.1 74.7 26.8
cavalli-6 99.0 87.1 32.1
cisapride 88.4 72.5 18.9
chloroquine 78.1 63.1 21.4
dofetilide 77.3 65.7 22.1
E-4031 79.8 66.5 23.3
haloperidol 83.8 71.9 19.3
terfenadine 97.8 84.4 34.5