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CCMS-UCSD / GNPSDocumentation

Documentation for GNPS and related tools as written in mkdocs
https://ccms-ucsd.github.io/GNPSDocumentation/
MIT License
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[GNPS] Missing information about the file conversion with the Schimadzu file format #103

Open lfnothias opened 4 years ago

lfnothias commented 4 years ago

I think @allegra-aron has some informations about it.

samuelbertrand44 commented 4 years ago

for shimadzu file conversion, from an ITTOF mass spec, some problems occurs during conversion with MSconvert. Their is a loss of resolution.

I advise you to use mergeCDF2MZxml (https://gitlab.univ-nantes.fr/bertrand-s-1/mergecdf2mzxml). If any problems are observed using this R script, do not hesitate to contact me.

explanation oof resolution loss is also added in this webage.

I hope this will help you.

mwang87 commented 4 years ago

Thanks! Do you have an example Shimadzu files we can test with?

samuelbertrand44 commented 4 years ago

Hi,

I have some files from LC-ITTOFMS that I planned to deposit on the gitlab page. I did not took time to do it yet. I will do it as soon as I come back from holiday.

Bye Samuel

Samuel BERTRAND,

Maitre de conférence (Assistant Professor) Ph.D. Chimie, M.Sc. Chimie (ENSCL)

Université de Nantes -> UFR des Sciences Pharmaceutiques et Biologiques, Tel: +33(0)2 53 48 43 10 (interne: 33 43 10) -> Laboratoire Mer, Molécules, Santé (EA 2160), Tel: +33(0)2 51 12 56 89 (interne: 45 56 89) 9 rue bias BP 61112, 44035 Nantes cedex 1, France

https://www.researchgate.net/profile/Samuel_Bertrand/ http://www.mms.univ-nantes.fr

http://bertrandsamuel.free.fr/gp2a/ http://bertrandsamuel.free.fr/siderophore_base/ http://scholar.google.com/citations?user=Y4_9oyMAAAAJ

Le 29 déc. 2019 à 23:43, Ming Wang notifications@github.com a écrit :

Thanks! Do you have an example Shimadzu files we can test with?

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