allison-group
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indigo-bondorder
indigo-bondorder PublicBondorder and formal charge determination for molecules
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structural-phylogenetics-bootstrap
structural-phylogenetics-bootstrap PublicScripts for preparing, running and processing MD and MC trajectories and for running the structure-based 'bootstrap' to gauge the robustness of structural phylogenetic relationships.
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RI
RI PublicForked from InfOmics/RI
RI is a general purpose algorithm for one-to-one exact subgraph isomorphism problem maintaining topological constraints.
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Repositories
- structural-phylogenetics-bootstrap Public
Scripts for preparing, running and processing MD and MC trajectories and for running the structure-based 'bootstrap' to gauge the robustness of structural phylogenetic relationships.
- HBondScript Public
- openbabel Public Forked from openbabel/openbabel
Open Babel is a chemical toolbox designed to speak the many languages of chemical data.
- TRAP Public
- indigox Public
- RI Public Forked from InfOmics/RI
RI is a general purpose algorithm for one-to-one exact subgraph isomorphism problem maintaining topological constraints.
- GROMACStutorial Public
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