From 81430e17a0fe2349f865ada6625f513e1c816b25 Mon Sep 17 00:00:00 2001
From: Katherine Heal
Date: Mon, 16 Dec 2024 15:01:43 -0800
Subject: [PATCH] Modify lipid documentation per docu squad's request
---
docs/README_LCMS_LIPID.md | 14 +++++++++-----
docs/index_lipid.html | 18 ++++++++++++------
docs/index_lipid.rst | 15 ++++++++++++---
3 files changed, 33 insertions(+), 14 deletions(-)
diff --git a/docs/README_LCMS_LIPID.md b/docs/README_LCMS_LIPID.md
index 9814c61..04f7922 100644
--- a/docs/README_LCMS_LIPID.md
+++ b/docs/README_LCMS_LIPID.md
@@ -1,6 +1,10 @@
+github_url
+
+:
+
# Lipidomics Workflow (v1.0.0)
-
+
## Workflow Overview
@@ -60,7 +64,9 @@ The in-silico lipid spectra in PNNL\'s Metaref database are generated
from the LipidBlast database (v68), found at
. Note that
there is no retention time in the PNNL version of the database and the
-workflow does not use retention time scoring.
+workflow does not use retention time scoring. Currently the workflow
+uses a local copy of the database, but the database is available by
+request.
## Sample datasets
@@ -95,9 +101,7 @@ The following inputs are required (declared in the input json file):
- Workflow inputs
- CoreMS Parameter file (.toml)
- Scan Translator Parameter file (.toml)
- - MetabRef configuration key (metabref.token). See MetabRef
- documentation () for how to
- generate a token.
+ - Path to local MetabRef database (.sqlite)
- Cores (optional input)
- How many cores to use for processing. Default is 1.
diff --git a/docs/index_lipid.html b/docs/index_lipid.html
index 952bc1d..de9741d 100644
--- a/docs/index_lipid.html
+++ b/docs/index_lipid.html
@@ -1,6 +1,13 @@
+
The liquid chromatography-mass spectrometry (LC-MS)-based lipidomics
@@ -51,7 +58,9 @@
Database
from the LipidBlast database (v68), found at https://systemsomicslab.github.io/compms/msdial/main.html.
Note that there is no retention time in the PNNL version of the database
-and the workflow does not use retention time scoring.
+and the workflow does not use retention time scoring. Currently the
+workflow uses a local copy of the database, but the database is
+available by request.
Sample datasets
An example dataset can be downloaded from here: Inputs
diff --git a/docs/index_lipid.rst b/docs/index_lipid.rst
index 81ae927..f5ac25f 100644
--- a/docs/index_lipid.rst
+++ b/docs/index_lipid.rst
@@ -1,7 +1,15 @@
+:github_url: https://github.com/microbiomedata/metaMS/blob/master/docs/index_lipid.rst
+
+..
+ Note: The above `github_url` field is used to force the target of the "Edit on GitHub" link
+ to be the specified URL. That makes it so the link will work, regardless of the Sphinx
+ site the file is incorporated into. You can learn more about the `github_url` field at:
+ https://sphinx-rtd-theme.readthedocs.io/en/stable/configuring.html#confval-github_url
+
Lipidomics Workflow (v1.0.0)
============================
-.. figure:: lipid_workflow_v1.png
+.. figure:: lipid_workflow_v1.svg
:alt: diagram of lipid workflow
Workflow Overview
@@ -60,7 +68,8 @@ Database
(https://metabref.emsl.pnnl.gov/)
The in-silico lipid spectra in PNNL's Metaref database are generated from the LipidBlast database (v68), found at https://systemsomicslab.github.io/compms/msdial/main.html.
-Note that there is no retention time in the PNNL version of the database and the workflow does not use retention time scoring.
+Note that there is no retention time in the PNNL version of the database and the workflow does not use retention time scoring.
+Currently the workflow uses a local copy of the database, but the database is available by request.
Sample datasets
---------------
@@ -95,7 +104,7 @@ The following inputs are required (declared in the input json file):
- Workflow inputs
- CoreMS Parameter file (.toml)
- Scan Translator Parameter file (.toml)
- - MetabRef configuration key (metabref.token). See MetabRef documentation (https://metabref.emsl.pnnl.gov/api) for how to generate a token.
+ - Path to local MetabRef database (.sqlite)
- Cores (optional input)
- How many cores to use for processing. Default is 1.