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igashov
commited on
Commit
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bec2844
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Parent(s):
52e7c95
header
Browse files
app.py
CHANGED
@@ -183,13 +183,16 @@ def generate(input_file, n_steps):
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demo = gr.Blocks()
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with demo:
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gr.Markdown('# DiffLinker: Equivariant 3D-Conditional Diffusion Model for Molecular Linker Design')
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-
gr.Markdown('[*Paper*](https://arxiv.org/abs/2210.05274) [*Code*](https://github.com/igashov/DiffLinker)')
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gr.Markdown(
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'Given a set of disconnected fragments in 3D, '
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'DiffLinker places missing atoms in between and designs a molecule incorporating all the initial fragments. '
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'Our method can link an arbitrary number of fragments, requires no information on the attachment atoms '
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'and linker size, and can be conditioned on the protein pockets.'
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)
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with gr.Box():
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with gr.Row():
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with gr.Column():
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demo = gr.Blocks()
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with demo:
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gr.Markdown('# DiffLinker: Equivariant 3D-Conditional Diffusion Model for Molecular Linker Design')
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gr.Markdown(
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'Given a set of disconnected fragments in 3D, '
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'DiffLinker places missing atoms in between and designs a molecule incorporating all the initial fragments. '
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'Our method can link an arbitrary number of fragments, requires no information on the attachment atoms '
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'and linker size, and can be conditioned on the protein pockets.'
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)
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+
gr.Markdown(
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'[**[Paper]**](https://arxiv.org/abs/2210.05274) '
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'[**[Code]**](https://github.com/igashov/DiffLinker)'
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)
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with gr.Box():
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with gr.Row():
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with gr.Column():
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