I'd like to try out NIST's hybrid search method. Is there a way to send MS to NIST MS Search directly from UA, like you can with the Qual & Quant version?
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I'd like to try out NIST's hybrid search method. Is there a way to send MS to NIST MS Search directly from UA, like you can with the Qual & Quant version?
Hello kingro ,
Currently spectrum can only be sent to NIST MS Search from qual and quant. The only workaround I could think of would be to export your component list from UA as a quant method and then reprocess in quant.
Just logged back in so thought I should add that this is possible. Open NIST MS Search and set your search option settings as you wish, leave the program open. Then with the component selected (only 1) use the Tools > Run Script option and run the 'GoToNIST' preset script.
To send multiple components at once you'll need to write your own script which exports data in .msp format which can be opened by NIST MS Search.
Just logged back in so thought I should add that this is possible. Open NIST MS Search and set your search option settings as you wish, leave the program open. Then with the component selected (only 1) use the Tools > Run Script option and run the 'GoToNIST' preset script.
To send multiple components at once you'll need to write your own script which exports data in .msp format which can be opened by NIST MS Search.