13 Jan New release of MassChemSite 3.1
We are happy to announce the official release of MassChemSite 3.1!
MassChemSite 3.1 includes the fix of some bugs found in MassChemSite 3.0.4 plus some new features:
- Improved UV detection:
MassChemSite 3.1 includes an improvement of the algorithm aimed for detect UV peaks. This new improvement improves the identification of peaks considering a better treatment from the noise. Additionally, it includes extra settings to allow the user to specify certain anticipation or delay of the UV signal related to the LC-MS one.
- Improvement of peak detection for saturated signals in UNIFI data:
Saturated data from Waters instrument compatible to UNIFI can now be pre-processed providing better results thanks to the saturation threshold included in MassChemSite.
- New chemical monitoring workflow for targeted analysis:
Chemical Monitoring workflow present in MassChemSite 3.0 was totally refurbished! The new Chemical Monitoring was thought as a targeted workflow ready to detect and identify more than 1000 compounds in a single run. Results are displayed in a compound-centric view to make an easy identification of the compounds of interest.
For more information and references: https://leadmolecular.com/masschemsite-3-1/
To request a test license or to update from MassChemSite 3.0, visit https://www.moldiscovery.com/software/masschemsite/
And to see what MassChemSite can do for you check the videos of Solutions for chemistry in https://leadmolecular.com/practical-applications-for-drug-discovery-2020-webinars/