Combined Translation Function to
Determine the Relative Position between A and B
We still have to determine the relative translation between molecules
A and B. The following XPLOR script file accomplishes this. This is
also an example of a translation function with a fixed portion (molecule
A).
The positions of molecules A and B are known up to a 0.5 translation.
Therefore, four translation functions have to be carried out.
translation12.inp
The first translation function is successful with a correlation
coefficient of 0.45. The corresponding Mathematica plot is shown in Fig. 19.5.
Figure 19.5:
Translation function.

XplorNIH 20231110