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. 2017 Nov 22;22(11):2029. doi: 10.3390/molecules22112029

Table 1.

Examples of some of the most popular currently available docking software. For a comprehensive list see [15].

Software Searching Algorithm Native Scoring Function 1 License
AutoDock [16] Stochastic Force-Field based Free for Academia
DOCK [17] Systematic Force-Field based Free for Academia
FlexX [18] Systematic Empirical Paid
Glide [19] Systematic Empirical Paid
GOLD [20] Stochastic Force-Field based Paid
ICM [21] Stochastic Force-Field based Paid
MOE [22] Stochastic Force-Field based Paid

1 Usually, the user can choose among several, often customizable, scoring functions. Here we report the type of scoring functions originally developed with the docking program.