HDXrate version 0.2.3

Changes:

• Added 3ala reference values (see DOI: 10.1021/acs.analchem.4c03631)
• Allow returning individual rate components (acid, base, water)

HDXrate version 0.2.2

Bugfix release

See #1 , thanks to @rgh2

Zenodo release

New release to trigger Zenodo DOI minting

Version 0.2.0 release

In this release the PSX implementation was removed and replaced by a new implementation of the Englander xls sheets.

Featuring DH, HD, HH exchanges rates with 'poly' or 'oligo' reference data and pH/pD correction.

Removed expfact

Expfact intrinsic rate calculation was removed from hdxrate

Updated license

Updated license text to GNU GPL v3

Initial Release

Initial release of HDXrate.

Currently features H/D exchange rate calculation for proteins based on primary structure, pH and temperature.