BioXTAS RAW News

I'm pleased to announce the release of RAW version 2.3.0. Significant changes include:

• Added the DENSS IFT method, which provides an open-source alternative to GNOM for IFTs with an adjustable Dmax parameter (unlike BIFT, which has a fixed, automatically determined, Dmax).
• Added the DENSS PDB2SAS method, which provides an open-source alternative to CRYSOL for predicting scattering profiles from models.
• High DPI support for plots on MacOS (requires matplotlib >= 3.9).
• High DPI support for the entire program on Windows (requires matplotlib >= 3.9).
• Compatibility updates for ATSAS 4.0.

Special thanks to Dr. Tom Grant, who did the major work on adding in the new DENSS IFT and PDB2SAS functions and documentation (along with developing the methods).

All changes:
* Added the DENSS IFT method, which provides an open-source alternative to GNOM for IFTs with adjustable Dmax parameters (unlike BIFT, which has a fixed, automatically determined, Dmax).
* Added the DENSS PDB2SAS method, which provides an open-source alternative to CRYSOL for predicting scattering profiles from models.
* High DPI support for plots on MacOS (requires matplotlib >= 3.9).
* High DPI support for the entire program on Windows (requires matplotlib >= 3.9).
* Fixed issues with pip installation.
* Fixed an API bug where the averageFrames method of the SECM object wouldn’t work on subtracted or baseline corrected series.
* Fixed a bug with running GNOM in the API.
* Added the dummy atom radius to the dammif/n results csv.
* Fixed an issue where CRYSOL could return an error if it didn’t find the model file.
* Added error dialogs for CRYSOL with more information on the problem.
* Fixed matplotlib 3.9 compatibility issues.
* Icons on MacOS (light mode) are now high DPI.