Figure 1.

RMS-Deviation in simulations of CALB. Root mean squared deviations of CALB backbone atoms from the X-ray structure as a function of time during simulations of 2 ns in (A) water and (B) in toluene showing three different simulations of the same system using different initial velocity distributions, indicated by different colors

Trodler and Pleiss BMC Structural Biology 2008 8:9   doi:10.1186/1472-6807-8-9
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