fmcs
Find Maximum Common Substructure
Install
- All systems
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curl cmd.cat/fmcs.sh
- Debian
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apt-get install python-fmcs - Ubuntu
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apt-get install python-fmcs - Windows (WSL2)
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sudo apt-get updatesudo apt-get install python-fmcs - Raspbian
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apt-get install python-fmcs - Dockerfile
- dockerfile.run/fmcs
python-fmcs
Find Maximum Common Substructure
Fcms finds the maximum common substructure (MCS) of a group (or cluster) of chemical structures and report the result as a SMARTS string. More specifically, the MCS found is a common edge subgraph, and not a common induced subgraph. Only connected MCSes are found.