S-cube v3.17 with sensitivity plots

1. Fixed the issue with environment variables.
2. Corrected the solvent sigma file for MeCN in PAL-XFEL, noting that simulations using MeCN in PAL-XFEL v3.16 had excessively large error estimates..

S-cube with sensitivity plots is guaranteed to work reliably in MATLAB 2020B and later on Windows 10 and RedHat-based Linux.

S-cube with sensitivity plots is detailed in the following papers:

"Estimating signal and noise of time-resolved X-ray solution scattering data at synchrotrons and XFELs", J. Kim, J. G. Kim, H. Ki, C. W. Ahn, H. Ihee*, J. Synchrotron Rad., 27, 633-645 (2020)

"Sensitivity of time-resolved diffraction data to changes in internuclear distances and atomic positions", H. Jeong, H. Ki, J. G. Kim, J. Kim, Y. Lee, and H. Ihee*, Bull. Korean Chem. Soc., 1-15 (2022)

S-cube v3.16 with sensitivity plots

Improving program stability.

S-cube with sensitivity plots is guaranteed to work reliably in MATLAB 2020B and later on Windows 10 and RedHat-based Linux.

S-cube with sensitivity plots is detailed in the following papers:

"Estimating signal and noise of time-resolved X-ray solution scattering data at synchrotrons and XFELs", J. Kim, J. G. Kim, H. Ki, C. W. Ahn, H. Ihee*, J. Synchrotron Rad., 27, 633-645 (2020)

"Sensitivity of time-resolved diffraction data to changes in internuclear distances and atomic positions", H. Jeong, H. Ki, J. G. Kim, J. Kim, Y. Lee, and H. Ihee*, Bull. Korean Chem. Soc., 1-15 (2022)

S-cube v3.15 with sensitivity plots

Solvent sigma files added for MeCN at XSS in PAL-XFEL.

S-cube is guaranteed to work reliably in MATLAB 2020B and later on Windows 10 and RedHat-based Linux.

S-cube with sensitivity plots is detailed in the following papers:

"Estimating signal and noise of time-resolved X-ray solution scattering data at synchrotrons and XFELs", J. Kim, J. G. Kim, H. Ki, C. W. Ahn, H. Ihee*, J. Synchrotron Rad., 27, 633-645 (2020)

"Sensitivity of time-resolved diffraction data to changes in internuclear distances and atomic positions", H. Jeong, H. Ki, J. G. Kim, J. Kim, Y. Lee, and H. Ihee*, Bull. Korean Chem. Soc., 1-15 (2022)

S-cube v3.14 with sensitivity plots

S-cube v3.14 with sensitivity plots

Icon added.

S-cube v3.14 is guaranteed to work reliably in MATLAB 2020B and later on Windows 10 and RedHat-based Linux.

S-cube v3.14 with sensitivity plots is detailed in the following papers:

"Estimating signal and noise of time-resolved X-ray solution scattering data at synchrotrons and XFELs", J. Kim, J. G. Kim, H. Ki, C. W. Ahn, H. Ihee*, J. Synchrotron Rad., 27, 633-645 (2020)

"Sensitivity of time-resolved diffraction data to changes in internuclear distances and atomic positions", H. Jeong, H. Ki, J. G. Kim, J. Kim, Y. Lee, and H. Ihee*, Bull. Korean Chem. Soc., 1-15 (2022)

S-cube v3.13 with sensitivity plots

Resolved an issue where unnecessary comments were generated when using the sensitivity plot function.

S-cube v3.13 is guaranteed to work reliably in MATLAB 2020B and later on Windows 10 and RedHat-based Linux.

S-cube v3.13 with sensitivity plots is detailed in the following papers:

"Estimating signal and noise of time-resolved X-ray solution scattering data at synchrotrons and XFELs", J. Kim, J. G. Kim, H. Ki, C. W. Ahn, H. Ihee*, J. Synchrotron Rad., 27, 633-645 (2020)

"Sensitivity of time-resolved diffraction data to changes in internuclear distances and atomic positions", H. Jeong, H. Ki, J. G. Kim, J. Kim, Y. Lee, and H. Ihee*, Bull. Korean Chem. Soc., 1-15 (2022)

S-cube v3.12 with sensitivity plots

Improve the UI to enable more intuitive interactions.
Exception handling for when the cage value is 0.
The boundaries of a specific parameter are appropriately set.

S-cube v3.12 is guaranteed to work reliably in MATLAB 2020B and later on Windows 10 and RedHat-based Linux.

S-cube v3.12 with sensitivity plots is detailed in the following papers:

"Estimating signal and noise of time-resolved X-ray solution scattering data at synchrotrons and XFELs", J. Kim, J. G. Kim, H. Ki, C. W. Ahn, H. Ihee*, J. Synchrotron Rad., 27, 633-645 (2020)

"Sensitivity of time-resolved diffraction data to changes in internuclear distances and atomic positions", H. Jeong, H. Ki, J. G. Kim, J. Kim, Y. Lee, and H. Ihee*, Bull. Korean Chem. Soc., 1-15 (2022)

S-cube v3.11 with sensitivity plots

The default value has been changed in the program update.

S-cube v3.11 is guaranteed to work reliably in MATLAB 2020B and later on Windows 10 and RedHat-based Linux.

S-cube v3.11 with sensitivity plots is detailed in the following papers:

"Estimating signal and noise of time-resolved X-ray solution scattering data at synchrotrons and XFELs", J. Kim, J. G. Kim, H. Ki, C. W. Ahn, H. Ihee*, J. Synchrotron Rad., 27, 633-645 (2020)

"Sensitivity of time-resolved diffraction data to changes in internuclear distances and atomic positions", H. Jeong, H. Ki, J. G. Kim, J. Kim, Y. Lee, and H. Ihee*, Bull. Korean Chem. Soc., 1-15 (2022)

S-cube with sensitivity plots

Bug fixes and stability improvements. Added the ability to select electron diffraction form factor.

S-cube is guaranteed to work reliably in MATLAB 2020B and later on Windows 10 and RedHat-based Linux.
S-cube with sensitivity plots is detailed in the following papers:
"Estimating signal and noise of time-resolved X-ray solution scattering data at synchrotrons and XFELs", J. Kim, J. G. Kim, H. Ki, C. W. Ahn, H. Ihee*, J. Synchrotron Rad., 27, 633-645 (2020)
"Sensitivity of time-resolved diffraction data to changes in internuclear distances and atomic positions", H. Jeong, H. Ki, J. G. Kim, J. Kim, Y. Lee, and H. Ihee*, Bull. Korean Chem. Soc., 1-15 (2022)

S-cube v3.7 with sensitivity plots

The figure for simulation results are improved. The figure saving functions are installed.

S-cube v3.7 is guaranteed to work reliably in MATLAB 2020B and later on Windows 10 and RedHat-based Linux.
S-cube v3.7 with sensitivity plots is detailed in the following papers:
"Estimating signal and noise of time-resolved X-ray solution scattering data at synchrotrons and XFELs", J. Kim, J. G. Kim, H. Ki, C. W. Ahn, H. Ihee*, J. Synchrotron Rad., 27, 633-645 (2020)
"Sensitivity of time-resolved diffraction data to changes in internuclear distances and atomic positions", H. Jeong, H. Ki, J. G. Kim, J. Kim, Y. Lee, and H. Ihee*, Bull. Korean Chem. Soc., 1-15 (2022)

S-cube v3.6 with sensitivity plots

The upper limit is changed from 1 to Inf for Excitation ratio and Thermal excitation ratio values.

S-cube v3.6 is guaranteed to work reliably in MATLAB 2020B and later on Windows 10 and RedHat-based Linux.
S-cube v3.6 with sensitivity plots is detailed in the following papers:
"Estimating signal and noise of time-resolved X-ray solution scattering data at synchrotrons and XFELs", J. Kim, J. G. Kim, H. Ki, C. W. Ahn, H. Ihee*, J. Synchrotron Rad., 27, 633-645 (2020)
"Sensitivity of time-resolved diffraction data to changes in internuclear distances and atomic positions", H. Jeong, H. Ki, J. G. Kim, J. Kim, Y. Lee, and H. Ihee*, Bull. Korean Chem. Soc., 1-15 (2022)