# HG changeset patch
# User goeckslab
# Date 1718045089 0
# Node ID 199b5f278356c32f7a3a537e348f0bbb82bcf322

planemo upload for repository https://github.com/goeckslab/tools-mti/tree/main/tools/scimap commit 9fb5578191db8a559191e45156cfb95350f01aea

diff -r 000000000000 -r 199b5f278356 anndata_to_csv.py
--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/anndata_to_csv.py	Mon Jun 10 18:44:49 2024 +0000
@@ -0,0 +1,45 @@
+import argparse
+import json
+import warnings
+
+import scimap as sm
+from anndata import read_h5ad
+
+
+def main(inputs, outfile):
+    """
+    Parameters
+    ---------
+    inputs : str
+        File path to galaxy tool parameter.
+    anndata : str
+        File path to anndata.
+    output : str
+        File path to output.
+    """
+    warnings.simplefilter('ignore')
+
+    with open(inputs, 'r') as param_handler:
+        params = json.load(param_handler)
+
+    adata = read_h5ad(params['anndata'])
+
+    if params['layer'] == 'x':
+        params['layer'] = None
+
+    df = sm.hl.scimap_to_csv(
+        adata=adata,
+        layer=params['layer'],
+        CellID=params['cellid'],
+    )
+
+    df.to_csv(outfile, index=False)
+
+
+if __name__ == '__main__':
+    aparser = argparse.ArgumentParser()
+    aparser.add_argument("-i", "--inputs", dest="inputs", required=True)
+    aparser.add_argument("-e", "--outfile", dest="outfile", required=True)
+    args = aparser.parse_args()
+
+    main(args.inputs, args.outfile)
diff -r 000000000000 -r 199b5f278356 anndata_to_csv.xml
--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/anndata_to_csv.xml	Mon Jun 10 18:44:49 2024 +0000
@@ -0,0 +1,56 @@
+<tool id="scimap_anndata_to_csv" name="Convert Anndata to CSV" version="@TOOL_VERSION@+galaxy@VERSION_SUFFIX@" profile="@PROFILE@">
+    <description>with Scimap</description>
+    <macros>
+        <import>main_macros.xml</import>
+    </macros>
+    <expand macro="scimap_requirements" />
+    <expand macro="macro_stdio" />
+    <version_command>echo "@VERSION@"</version_command>
+    <command detect_errors="aggressive">
+        <![CDATA[
+        python '$__tool_directory__/anndata_to_csv.py'
+            --inputs '$inputs'
+            --outfile '$outfile'
+
+        ]]>
+    </command>
+    <configfiles>
+        <inputs name="inputs" data_style="paths"/>
+    </configfiles>
+    <inputs>
+        <param name="anndata" type="data" format="h5ad" label="Select the input anndata" />
+        <param name="layer" type="select" label="Select the Anndata layer to export">
+            <option value="x">adata.X</option>
+            <option value="raw">adata.raw.X</option>
+        </param>
+        <param name="cellid" type="text" value="CellID" label="Name of column containing Cell IDs" />
+    </inputs>
+    <outputs>
+        <data format="csv" name="outfile" />
+    </outputs>
+    <tests>
+        <test>
+            <param name="anndata" value="tutorial_data.h5ad" />
+            <param name="layer" value="x" />
+            <output name="outfile" ftype="csv">
+                <assert_contents>
+                    <has_n_columns n="41" sep="," />
+                    <has_n_lines n="500" />
+                </assert_contents>
+            </output>
+        </test>
+    </tests>
+    <help>
+        <![CDATA[
+**What it does**
+
+This scimap function converts from Anndata format to CSV.
+There are three options for the data matrix returned: 
+1) the current contents of adata.X
+2) the current contents of adata.raw.X
+3) the current contents of adata.raw.X with a log+1 transformation applied 
+
+        ]]>
+    </help>
+    <expand macro="citations" />
+</tool>
diff -r 000000000000 -r 199b5f278356 main_macros.xml
--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/main_macros.xml	Mon Jun 10 18:44:49 2024 +0000
@@ -0,0 +1,33 @@
+<macros>
+    <token name="@TOOL_VERSION@">2.1.0</token>
+    <token name="@VERSION_SUFFIX@">0</token>
+    <token name="@PROFILE@">20.01</token>
+
+    <xml name="scimap_requirements">
+        <requirements>
+            <container type="docker">quay.io/goeckslab/scimap:@TOOL_VERSION@</container>
+            <yield />
+        </requirements>
+    </xml>
+
+    <xml name="macro_stdio">
+        <stdio>
+            <exit_code range="1:" level="fatal" description="Error occurred. Please check Tool Standard Error" />
+        </stdio>
+    </xml>
+    <xml name="citations">
+        <citations>
+            <citation type="doi">10.1158/2159-8290.CD-21-1357</citation>
+        </citations>
+    </xml>
+    <xml name="scimap_spatial_options" token_label="spatial_aggregate">
+        <section name="options" title="Advanced Options" expanded="false">
+            <param argument="x_coordinate" type="text" value="X_centroid" optional="false" label="Column name containing the x-coordinates values" />
+            <param argument="y_coordinate" type="text" value="Y_centroid" optional="false" label="Column name containing the y-coordinates values" />
+            <yield/>
+            <param argument="imageid" type="text" value="imageid" optional="true" label="Column name of the column containing the image id" />
+            <param argument="subset" type="text" value="" optional="true" label="Imageid of a single image to be subsetted for analyis" />
+            <param argument="label" type="text" value="@LABEL@" optional="true" label="Key for the returned data" help="Stored in adata.obs" />
+        </section>
+    </xml>
+</macros>
diff -r 000000000000 -r 199b5f278356 mcmicro_to_anndata.py
--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/mcmicro_to_anndata.py	Mon Jun 10 18:44:49 2024 +0000
@@ -0,0 +1,49 @@
+import argparse
+import json
+import warnings
+
+import scimap as sm
+
+
+def main(inputs, outfile):
+    """
+    Parameter
+    ---------
+    inputs : str
+        File path to galaxy tool parameter.
+
+    outfile : str
+        File path to estimator.
+    """
+    warnings.simplefilter('ignore')
+
+    with open(inputs, 'r') as param_handler:
+        params = json.load(param_handler)
+
+    image_path = params['image_path']
+    drop_markers = params['drop_markers']
+    if not drop_markers:
+        drop_markers = None
+    else:
+        drop_markers = [x.strip() for x in drop_markers.split(',')]
+    options = params['options']
+    for k, v in options.items():
+        if v == '':
+            options[k] = None
+
+    adata = sm.pp.mcmicro_to_scimap(
+        image_path,
+        drop_markers=drop_markers,
+        **options
+    )
+
+    adata.write(outfile)
+
+
+if __name__ == '__main__':
+    aparser = argparse.ArgumentParser()
+    aparser.add_argument("-i", "--inputs", dest="inputs", required=True)
+    aparser.add_argument("-e", "--outfile", dest="outfile", required=True)
+    args = aparser.parse_args()
+
+    main(args.inputs, args.outfile)
diff -r 000000000000 -r 199b5f278356 scimap_phenotyping.py
--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/scimap_phenotyping.py	Mon Jun 10 18:44:49 2024 +0000
@@ -0,0 +1,120 @@
+import argparse
+import warnings
+
+import pandas as pd
+import scimap as sm
+from anndata import read_h5ad
+
+
+def main(
+    adata,
+    output,
+    log,
+    gating_workflow,
+    gating_workflow_ext,
+    manual_gates=None,
+    manual_gates_ext=None,
+    random_state=0
+):
+    """
+    Parameter
+    ---------
+    adata : str
+        File path to the input AnnData.
+    output : str
+        File path to the output AnnData.
+    log: bool
+        Boolean whether to log the input data prior to rescaling
+    gating_workflow : str
+        File path to the gating workflow.
+    gating_workflow_ext : str
+        Datatype for gating workflow, either 'csv' or 'tabular'.
+    manual_gates : str
+        File path to the munual gating.
+    manual_gates_ext : str
+        Datatype for munual gate, either 'csv' or 'tabular'.
+    random_state: int
+        The seed used by the random number generator for GMM in sm.pp.rescale
+    """
+    warnings.simplefilter('ignore')
+
+    adata = read_h5ad(adata)
+    # Rescale data
+    if manual_gates:
+        sep = ',' if manual_gates_ext == 'csv' else '\t'
+        manual_gates = pd.read_csv(manual_gates, sep=sep)
+
+    adata = sm.pp.rescale(
+        adata,
+        gate=manual_gates,
+        log=log,
+        random_state=random_state
+    )
+
+    # Phenotype cells
+    # Load the gating workflow
+    sep = ',' if gating_workflow_ext == 'csv' else '\t'
+    phenotype = pd.read_csv(gating_workflow, sep=sep)
+    adata = sm.tl.phenotype_cells(
+        adata,
+        phenotype=phenotype,
+        label="phenotype"
+    )
+
+    # Summary of the phenotyping
+    print(adata.obs['phenotype'].value_counts())
+
+    adata.write(output)
+
+
+if __name__ == '__main__':
+    aparser = argparse.ArgumentParser()
+    aparser.add_argument("-a", "--adata", dest="adata", required=True)
+    aparser.add_argument("-o", "--output", dest="output", required=True)
+    aparser.add_argument("-l", "--log", dest="log", action="store_true")
+    aparser.add_argument(
+        "-g",
+        "--gating_workflow",
+        dest="gating_workflow",
+        required=True
+    )
+    aparser.add_argument(
+        "-s",
+        "--gating_workflow_ext",
+        dest="gating_workflow_ext",
+        required=True
+    )
+    aparser.add_argument(
+        "-m",
+        "--manual_gates",
+        dest="manual_gates",
+        required=False
+    )
+    aparser.add_argument(
+        "-S",
+        "--manual_gates_ext",
+        dest="manual_gates_ext",
+        required=False
+    )
+    aparser.add_argument(
+        "--random_state",
+        dest="random_state",
+        type=int,
+        required=False
+    )
+
+    args = aparser.parse_args()
+
+    if args.log:
+        print("\n adata.raw.X will be log1p transformed \n")
+
+    main(
+        adata=args.adata,
+        output=args.output,
+        log=args.log,
+        gating_workflow=args.gating_workflow,
+        gating_workflow_ext=args.gating_workflow_ext,
+        manual_gates=args.manual_gates,
+        manual_gates_ext=args.manual_gates_ext,
+        random_state=args.random_state
+    )
diff -r 000000000000 -r 199b5f278356 scimap_plotting.py
--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/scimap_plotting.py	Mon Jun 10 18:44:49 2024 +0000
@@ -0,0 +1,125 @@
+import argparse
+import json
+import os
+import warnings
+
+import matplotlib.pylab as plt
+import numpy as np
+import scimap as sm
+import seaborn as sns
+from anndata import read_h5ad
+
+sns.set(color_codes=True)
+
+
+def main(inputs, anndata, output):
+    """
+    Parameter
+    ---------
+    inputs : str
+        File path to galaxy tool parameter.
+    anndata : str
+        File path to anndata containing phenotyping info.
+    output : str
+        File path to output.
+    """
+    warnings.simplefilter('ignore')
+
+    with open(inputs, 'r') as param_handler:
+        params = json.load(param_handler)
+
+    adata = read_h5ad(anndata)
+
+    tool = params['analyses']['selected_tool']
+    options = params['analyses']['options']
+
+    if tool == 'stacked_barplot':
+
+        # parse list text arguments
+        for o in options.copy():
+            opt_list = options.pop(o)
+            if opt_list:
+                options[o] = [x.strip() for x in opt_list.split(',')]
+
+        # add base args into options dict to pass to tool
+        options['x_axis'] = params['analyses']['x_axis']
+        options['y_axis'] = params['analyses']['y_axis']
+        options['method'] = params['analyses']['method']
+
+        options['return_data'] = True
+
+        df = sm.pl.stacked_barplot(adata, **options)
+
+        # Pick cmap to use
+        num_phenotypes = len(df.columns) - 1
+        if num_phenotypes <= 9:
+            matplotlib_cmap = "Set1"
+        elif num_phenotypes > 9 and num_phenotypes <= 20:
+            matplotlib_cmap = plt.cm.tab20
+        else:
+            matplotlib_cmap = plt.cm.gist_ncar
+
+        # Plotting
+        sns.set_theme(style="white")
+        ax = df.plot.bar(stacked=True, cmap=matplotlib_cmap)
+        fig = ax.get_figure()
+        handles, labels = ax.get_legend_handles_labels()
+        ax.legend(
+            reversed(handles),
+            reversed(labels),
+            bbox_to_anchor=(1, 1),
+            loc='upper left'
+        )
+        plt.tight_layout()
+
+        # # save and close
+        fig.savefig('out.png', dpi=300)
+        plt.close(fig)
+
+    if tool == 'voronoi':
+
+        plt.style.use('fast')
+
+        tool_func = getattr(sm.pl, tool)
+
+        # x_lim/y_lim need to be parsed from comma-sep str to integer tuples
+        for lim in ['x_lim', 'y_lim']:
+            opt_list = options.pop(lim)
+            if opt_list:
+                options[lim] = [int(x.strip()) for x in opt_list.split(',')]
+
+        # parse list text arguments
+        for cat in ['overlay_points_categories', 'overlay_drop_categories']:
+            opt_list = options.pop(cat)
+            if opt_list:
+                options[cat] = [x.strip() for x in opt_list.split(',')]
+
+        # add base args into options dict to pass to tool
+        options['color_by'] = params['analyses']['color_by']
+        options['x_coordinate'] = params['analyses']['x_coordinate']
+        options['y_coordinate'] = params['analyses']['y_coordinate']
+
+        # fill any missing params with None as tool expects
+        for k, v in options.items():
+            if v == '':
+                options[k] = None
+
+        options['saveDir'] = os.getcwd()
+        options['fileName'] = 'out.png'
+
+        if options['size_max'] is None:
+            options['size_max'] = np.inf
+
+        # call the tool and unpack all options
+        tool_func(adata, **options)
+
+
+if __name__ == '__main__':
+    aparser = argparse.ArgumentParser()
+    aparser.add_argument("-i", "--inputs", dest="inputs", required=True)
+    aparser.add_argument("-a", "--anndata", dest="anndata", required=True)
+    aparser.add_argument("-e", "--output", dest="output", required=True)
+
+    args = aparser.parse_args()
+
+    main(args.inputs, args.anndata, args.output)
diff -r 000000000000 -r 199b5f278356 scimap_spatial.py
--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/scimap_spatial.py	Mon Jun 10 18:44:49 2024 +0000
@@ -0,0 +1,62 @@
+import argparse
+import json
+import warnings
+
+import scimap as sm
+from anndata import read_h5ad
+
+
+def main(inputs, anndata, output):
+    """
+    Parameter
+    ---------
+    inputs : str
+        File path to galaxy tool parameter.
+    anndata : str
+        File path to anndata containing phenotyping info.
+    output : str
+        File path to output.
+    """
+    warnings.simplefilter('ignore')
+
+    with open(inputs, 'r') as param_handler:
+        params = json.load(param_handler)
+
+    adata = read_h5ad(anndata)
+
+    tool = params['analyses']['selected_tool']
+    tool_func = getattr(sm.tl, tool)
+
+    options = params['analyses']['options']
+    if tool == 'cluster':
+        options['method'] = params['analyses']['method']
+        subset_genes = options.pop('subset_genes')
+        if subset_genes:
+            options['subset_genes'] = \
+                [x.strip() for x in subset_genes.split(',')]
+        sub_cluster_group = options.pop('sub_cluster_group')
+        if sub_cluster_group:
+            options['sub_cluster_group'] = \
+                [x.strip() for x in sub_cluster_group.split(',')]
+
+    for k, v in options.items():
+        if v == '':
+            options[k] = None
+
+    tool_func(adata, **options)
+
+    if tool == 'spatial_lda':
+        adata.uns.pop('spatial_lda_model')
+
+    adata.write(output)
+
+
+if __name__ == '__main__':
+    aparser = argparse.ArgumentParser()
+    aparser.add_argument("-i", "--inputs", dest="inputs", required=True)
+    aparser.add_argument("-e", "--output", dest="output", required=True)
+    aparser.add_argument("-a", "--anndata", dest="anndata", required=True)
+
+    args = aparser.parse_args()
+
+    main(args.inputs, args.anndata, args.output)
diff -r 000000000000 -r 199b5f278356 test-data/manual_gates.csv
--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/test-data/manual_gates.csv	Mon Jun 10 18:44:49 2024 +0000
@@ -0,0 +1,19 @@
+markers,gate
+ASMA,6.6
+CD163,6.6
+CD206,7.5
+CD68,6.2
+CD20,7.8
+CD21,8
+CD3D,6.5
+CD45,7.3
+CD56,8.7
+CD8A,6.5
+FOXP3,5.2
+CD11B,6.7
+CD11C,6.3
+CD15,7.9
+CD4,7.4
+PD1,7.9
+HLADR,6.7
+CD25,7
\ No newline at end of file
diff -r 000000000000 -r 199b5f278356 test-data/mcmicro_output.csv
--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/test-data/mcmicro_output.csv	Mon Jun 10 18:44:49 2024 +0000
@@ -0,0 +1,500 @@
+CellID,DNA1,BG1,BG2,BG3,DNA2,CD25,CD2,CD10,DNA3,CD163,CD3D,CD5,DNA4,CD30,ACTIN,CD45,DNA5,CD206,CD68,PD1,DNA6,KI67,CD11C,CD7,DNA7,CD8A,FOXP3,CD20,DNA8,CD4,HLADR,PSTAT3,DNA9,PS6,PERK,CD21,DNA10,CD43,NOS2,PDL1,DNA11,CD11B,CD57,MHCI,DNA12,CD15,ASMA,CD56,X_centroid,Y_centroid,Area,MajorAxisLength,MinorAxisLength,Eccentricity,Solidity,Extent,Orientation
+1,16640.5641,719.6324786,527.7094017,1100.273504,14726.17094,581.5811966,618.3846154,1606.777778,7182.247863,509.3247863,477.5897436,1795.410256,10677.03419,1084.051282,5382.076923,2983.239316,3771.91453,1103.111111,399.3418803,2705.57265,7494.65812,1599.940171,757.7692308,451.6324786,8504.008547,389.8547009,109.042735,7809.042735,7239.435897,1408.564103,807.2393162,2814.196581,5718.74359,617.4273504,260.0598291,20362.76923,3721.222222,756.3589744,370.4615385,1334.666667,3247.74359,969.8034188,148.5726496,4133.598291,2508.555556,1085.735043,218.5470085,3170.470085,511.5555556,9.846153846,117,14.53227038,10.27362788,0.707260822,0.959016393,0.75,-0.695369483
+2,16938.30097,686.5533981,469.3009709,1048.048544,14650.61165,565.8932039,442.2912621,1539.398058,7244.252427,496.8252427,484.9029126,1793.932039,10165.42718,1056.427184,3202.825243,2895.475728,3729.495146,1076.504854,352.3980583,2904.805825,6971.31068,5288.281553,725.8446602,433.0485437,8211.699029,380.2524272,101.9320388,4205.223301,7051.174757,1366.407767,998.4951456,2812.883495,5586.271845,594.7281553,244.7669903,5087.757282,3746,790.631068,349.2038835,1326.640777,3062.407767,867.8932039,143.3300971,2705.466019,2386.116505,1075.640777,164.4854369,3116.76699,579.3300971,9.398058252,103,16.0562861,8.776322775,0.837395595,0.903508772,0.613095238,1.115706828
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diff -r 000000000000 -r 199b5f278356 test-data/phenotype_workflow.csv
--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/test-data/phenotype_workflow.csv	Mon Jun 10 18:44:49 2024 +0000
@@ -0,0 +1,23 @@
+,,ASMA,CD163,CD206,CD68,CD20,CD21,CD3D,CD45,CD56,CD8A,FOXP3,CD11B,CD11C,CD15,CD4,PD1,HLADR,CD25
+all,Other Immune cells,,,,,,,,pos,,,,,,,,,,
+all,ASMA+ cells,pos,,,,,,,,,,,,,,,,,
+Other Immune cells,T cells,,,,,,,pos,,,,,,,,,,,
+Other Immune cells,B cells,,,,,pos,,,,,,,,,,,,,
+Other Immune cells,Myeloid Lineage,,anypos,anypos,anypos,,,,,,,,anypos,anypos,,,,,
+Other Immune cells,NK cells,,,,,,,,,pos,,,,,,,,,
+Other Immune cells,Granulocytes,,,,,,,,,,,,,,pos,,,,
+Myeloid Lineage,T cells,,,,,,,pos,,,,,,,,,,,
+Myeloid Lineage,B cells,,,,,pos,,,,,,,,,,,,,
+Myeloid Lineage,NK cells,,,,,,,,,pos,,,,,,,,,
+Myeloid Lineage,Granulocytes,,,,,,,,,,,,,,pos,,,,
+T cells,CD4 T cells,,,,,,,,,,,,,,,pos,,,
+T cells,CD8 T cells,,,,,,,,,,pos,,,,,,,,
+CD4 T cells,Regulatory T cells,,,,,,,,,,,pos,,,,,,,
+CD4 T cells,Follicular Helper T cells,,,,,,,,,,,,,,,,pos,,
+CD8 T cells,PD1+ T cells,,,,,,,,,,,,,,,,pos,,
+Myeloid Lineage,CD68+ Macrophages,,,,pos,,,,,,,,,,,,,,
+Myeloid Lineage,M2 Macrophages,,anypos,anypos,,,,,,,,,,,,,,,
+Myeloid Lineage,Myeloid Dendritic cells,,,,,,,,,,,,,,,,,pos,
+Myeloid Lineage,Follicular Dendritic cells,,,,,,pos,,,,,,,,,,,,
+CD68+ Macrophages,M1 Macrophages,,,,,,,,,,,,,,,,,pos,
+Myeloid Dendritic cells,CD25+ Dendritic cells,,,,,,,,,,,,,,,,,,pos
\ No newline at end of file
diff -r 000000000000 -r 199b5f278356 test-data/tutorial_data.h5ad
Binary file test-data/tutorial_data.h5ad has changed
diff -r 000000000000 -r 199b5f278356 test-data/tutorial_data_pheno.h5ad
Binary file test-data/tutorial_data_pheno.h5ad has changed