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chore: added documentation for 2D and 3D sdfs downloads
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sriramkanakam87 committed Dec 12, 2024
1 parent c12084a commit f856c51
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1 change: 1 addition & 0 deletions docs/.vitepress/config.mts
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Expand Up @@ -52,6 +52,7 @@ export default defineConfig({
{ text: 'Versions', link: '/versions' },
{ text: 'Data', link: '/data-base' },
{ text: 'Use Cases', link: '/use-cases' },
{ text: '2D/3D SDFs', link: '/2d-3d-sdfs' },
]
},
{
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30 changes: 30 additions & 0 deletions docs/2d-3d-sdfs.md
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# Download idividual 2D and 3D SDFs for each molecule

COCONUT provides users with options to download 2D and 3D coordinates data in SDF format. These are generated using RDKit. The name of the file would be the COCONUT Identifier (*Ex: CNP0228556.0.sdf*)

::: info Where to find?
Right panel of the compound page
:::

![Database Downloads](/2d-3d-sdfs.png)


<style>
table {
width: 100%;
border-collapse: collapse;
}
th, td {
border: 1px solid #ddd;
padding: 8px;
}
th {
background-color: #f2f2f2;
}
td {
text-align: left;
}
td:nth-child(1), td:nth-child(3) {
text-align: center;
}
</style>
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