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  1. mspcompiler mspcompiler Public

    Compile Mass Spectral Libraries from Various Sources

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  2. MS-libraries MS-libraries Public

    Contains either MS/MS libraries built in-house

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  3. fcmsafety fcmsafety Public

    The main function of this package is to evaluate the safety of compounds from food contact materials. It takes into account the toxicity data from ECHA's Substances of Very High Concern (SVHC), Car…

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  4. apps-ambit apps-ambit Public

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    Applications using AMBIT and examples how to call AMBIT modules

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  5. labtools labtools Public

    This package aims to provide a set of tools to help facilitate the handling of laboratory data. At the moment, there is only one function to help read and align compound lists of different samples.…

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