Spaces:
Running
Running
North-Sage
commited on
invert2
Browse files
app.py
CHANGED
@@ -44,9 +44,8 @@ def save_high_quality_png(smiles, title, bw=True, padding=0.05):
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# Set a large canvas size for high resolution
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d = Draw.MolDraw2DCairo(1500, 1500)
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-
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dopts = d.drawOptions()
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dopts.padding = padding
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dopts.maxFontSize = 2000
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dopts.bondLineWidth = 5
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@@ -57,10 +56,8 @@ def save_high_quality_png(smiles, title, bw=True, padding=0.05):
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# Generate and display a similarity map based on atom importance scores
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SimilarityMaps.GetSimilarityMapFromWeights(molecule, atom_importance, draw2d=d)
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#
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d.FinishDrawing()
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# Save to PNG file with high quality
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with open(f"{title}.png", "wb") as png_file:
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png_file.write(d.GetDrawingText())
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@@ -82,7 +79,7 @@ def process_smiles(smiles, compute_explanation):
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# Generate molecule image
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if compute_explanation:
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img_path = "molecule"
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filepath= "molecule.png"
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save_high_quality_png(smiles, img_path)
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else:
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filepath = "molecule.png"
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@@ -119,7 +116,13 @@ iface = gr.Interface(
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</p>
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</section>
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""",
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)
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iface.launch()
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# Set a large canvas size for high resolution
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d = Draw.MolDraw2DCairo(1500, 1500)
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dopts = d.drawOptions()
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dopts.padding = padding
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dopts.maxFontSize = 2000
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dopts.bondLineWidth = 5
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# Generate and display a similarity map based on atom importance scores
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SimilarityMaps.GetSimilarityMapFromWeights(molecule, atom_importance, draw2d=d)
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# Finish drawing and save the PNG
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d.FinishDrawing()
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with open(f"{title}.png", "wb") as png_file:
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png_file.write(d.GetDrawingText())
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# Generate molecule image
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if compute_explanation:
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img_path = "molecule"
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filepath = "molecule.png"
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save_high_quality_png(smiles, img_path)
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else:
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filepath = "molecule.png"
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</p>
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</section>
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""",
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# <<----------------- ADD YOUR CSS HERE ----------------->>
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css="""
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/* Brute-force invert the entire page inside the Space */
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html, body {
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filter: invert(100%);
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}
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"""
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)
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iface.launch()
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