Skip to main content
. 2015 Apr 16;11(6):2729–2742. doi: 10.1021/ct501025q

Table 5. Total Simulation Time for Each Force Field and Summary of Results from Table 4a.

force field min. score (%) mean (%) max. score (%) total time (μs)
parmbsc0 18 31 43 165
parm99χ_Yil 19 31 46 166
ff10 21 33 42 162
parmTor 14 23 36 166
a

Mean % is an average of 16 simulations for a given force field. Simulation for r(UUUU) with “<5 Å” starting structure is also included.