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Allow reading of v3000 connection tables
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awvwgk committed Feb 26, 2022
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2 changes: 2 additions & 0 deletions doc/format-ctfile.md
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Expand Up @@ -8,6 +8,7 @@ title: Connection table format

The molfile is identified by the extension ``mol`` and the structure data format
is identified by ``sdf``.
Both V2000 and V3000 connection tables can be read.

## Example

Expand Down Expand Up @@ -55,6 +56,7 @@ The following features are currently not supported:

- Not all modifiers are supported for the connection table
- SDF key-value pair annotations are dropped
- continuation lines in V3000 format are not supported

@Note Feel free to contribute support for missing features
or bring missing features to our attention by opening an issue.
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