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A brute-force implementation to molecular assembly in Rust.

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moas - Molecular Assembler

A brute-force implementation to molecular assembly in Rust.

By assembling a multiset of subgraphs into possible molecular graphs, new drugs could be discovered. This repository is part of my masters thesis at the TU Dortmund.

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This code is licensed under the MIT license, see LICENSE.

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A brute-force implementation to molecular assembly in Rust.

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