::!\bin\csh -f :: awa970502 version 1.1 :: examples taken from the origional documentation :: :: Calculate difference patterson Example :: :: Section along all 3 axes to make it easy to contour Harker sections. :: Do all maps over whole asymmetric unit to be sure each section :: is on the same scale. :: X sections :: fft HKLIN %TOXD%\toxd MAPOUT %TEMPRES%\toxd_aupatt_x < %SCRIPTWIN%\fft1.dat :: Y sections :: fft HKLIN %TOXD%\toxd MAPOUT %TEMPRES%\toxd_aupatt_y < %SCRIPTWIN%\fft2.dat :: Z sections :: fft HKLIN %TOXD%\toxd MAPOUT %TEMPRES%\toxd_aupatt_z < %SCRIPTWIN%\fft3.dat :: :: Calculate anomalous difference patterson Example :: :: X sections :: fft HKLIN %TOXD%\toxd MAPOUT %TEMPRES%\toxd_auanopatt_x < %SCRIPTWIN%\fft4.dat :: Extract sample results for testing purposes - these can :: be compared with runs with different versions or on different :: platforms echo " " > %TEMPRES%\sample_results echo " *** fft.exam *** " > %TEMPRES%\sample_results echo " " > %TEMPRES%\sample_results mapdump mapin %TEMPRES%\toxd_auanopatt_x.map < %SCRIPTWIN%\end.dat > %TEMPRES%\junk find "Mean density" %TEMPRES%\junk > %TEMPRES%\sample_results find "Rms deviation from mean density" %TEMPRES%\junk > %TEMPRES%\sample_results del %TEMPRES%\junk