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Greg Landrum 942c0b7f2a Adds additional capabilities to the minimal JS wrapper (#2676 )

* add functions for ketcher

* support highlighting bonds from SSS

* add get_substruct_matches

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demo

Adds additional capabilities to the minimal JS wrapper (#2676 )

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docker

Add minimal JavaScript wrapper (#2444 )

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tests

Add minimal JavaScript wrapper (#2444 )

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CMakeLists.txt

Add minimal JavaScript wrapper (#2444 )

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jswrapper.cpp

Adds additional capabilities to the minimal JS wrapper (#2676 )

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minilib.cpp

Adds additional capabilities to the minimal JS wrapper (#2676 )

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minilib.h

Adds additional capabilities to the minimal JS wrapper (#2676 )

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README.md

Add minimal JavaScript wrapper (#2444 )

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testMinilib.cpp

Add minimal JavaScript wrapper (#2444 )

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README.md

JavaScript wrappers for the RDKit

Note These wrappers should be considered experimental. The API is not yet stable and may change from release to release.

The idea here is to allow the RDKit to be used from JavaScript so that we can add chemical capabilities to web applications. Rather than attempting a comprehensive wrapper (like RDKitJS), this exposes a small set of key functionality. I think the general approach, including this actual library, can be useful for other wrapper projects in the future.

This initial set of functionality is not complete, but it is intended to already be directly useful.

The Dockerfile in the docker/ shows how to setup an appropriate environment and build the wrappers.