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Help with Data Input and Processing in MS-CleanR from Agilent .D Format #15

Closed Javi-Rop closed 11 months ago

Javi-Rop commented 12 months ago

Hello everyone,

I'm seeking guidance and assistance with introducing and processing data in the .D format generated by Agilent instruments in MS-CleanR. I would greatly appreciate it if someone could provide information on the format and file extension of data files that are compatible with MS-CleanR and how to carry out the conversion and processing of .D files in this tool.

Additionally, I have encountered the following error when attempting to load the data into MS-CleanR:

Error: A pos or a neg directory must be present. Check your data and your parameters. If the problem persists, you can contact guillaume.marti@univ-tlse3.fr.

My main questions include:

What is the required format and file extension for data input in MS-CleanR?

What is the recommended process for converting .D files generated by Agilent instruments into formats compatible with MS-CleanR, such as .mzML, .mzXML, or .cdf?

Are there specific steps or recommendations for preparing and organizing data before loading it into MS-CleanR?

Any information, resources, or examples related to data input and processing in MS-CleanR would be greatly appreciated by me and other community members who may have the same question.

Thank you in advance for your cooperation and assistance!

Best regards, Javier Rodríguez

guikool commented 11 months ago

Please, read the tutorial from github repo, All data must be processed through MSDial 4.x