rdkit-cli
importedtherapeutics/rdkit-cli
Python command line tool for rdkit library, fast, simple and reactive
Machine-generated from the listed sources and not yet reviewed by a human.
- Category
- Therapeutics
- Subcategory
- unknown
- License
- Apache-2.0(osi)
- Status
- active
- Maturity
- deployed
- Organization
- unknown
- Country
- unknown
- Homepage
- unknown
- Repository
- github.com/Vitruves/rdkit-cli
- Documentation
- unknown
- Tags
- cheminformatics · cli · command-line-tool · computational-chemistry · drug-discovery · fingerprints · molecular-descriptors · python · rdkit · sdf · smiles
- Regulatory
- unknown
Computed from shared tags, weighted so a rare tag counts for more than a common one. These are suggestions, not curated relationships.
- chematiccheminformatics · drug-discovery · fingerprints · rdkit · smiles
A pure-Rust cheminformatics library targeting RDKit feature parity — zero C/C++ by default.
- ALKYLcheminformatics · computational-chemistry · drug-discovery · rdkit · smiles
Claude Plugin for CompChem , Drug Discovery & Organic Chemistry reasoning
- qedcheminformatics · molecular-descriptors · rdkit
The QED (Quantitative Estimation of Drug-likeness) molecular descriptor to use in combination with RDKit
- molgencheminformatics · drug-discovery · rdkit · smiles
Lightweight toolkit for de novo molecular generation: SMILES & SELFIES tokenizers, CharRNN / MolGPT / VAE models, training, sampling, and MOSES-style metrics.
- Rcpicheminformatics · drug-discovery · molecular-descriptors
💊 Molecular informatics toolkit with integration of bioinformatics and cheminformatics tools for drug discovery
- drug-discovery-agent-skillscheminformatics · computational-chemistry · drug-discovery · rdkit
Agent Skills for small-molecule and protein therapeutics: cheminformatics, molecular ML, docking and dynamics, protein design platforms, and target-discovery knowledge graphs.
- api.github.com/repos/Vitruves/rdkit-cliretrieved 2026-08-25 · via github-api
Machine-imported from GitHub search. Last push 2026-04-03, 4 stars, license reported as Apache-2.0. Category and schematic were assigned by keyword heuristics and are unreviewed.
Not yet verified by a human. Correct this record →
/v1/entries/10.json→ .entries["rdkit-cli"]
Entries are sharded 64 ways by a stable hash of the id, so a consumer can find any record without an index.