AMPL
importedtherapeutics/ampl
The ATOM Modeling PipeLine (AMPL) is an open-source, modular, extensible software pipeline for building and sharing models to advance in silico drug discovery.
Machine-generated from the listed sources and not yet reviewed by a human.
- Category
- Therapeutics
- Subcategory
- unknown
- License
- MIT(osi)
- Status
- active
- Maturity
- deployed
- Organization
- ATOMScience-org
- Country
- unknown
- Homepage
- unknown
- Repository
- github.com/ATOMScience-org/AMPL
- Documentation
- unknown
- Tags
- cheminformatics · chemistry · chemistry-discovery · machine-learning · math-physics · nci-doe-collaboration-capability · neural-network · python
- Regulatory
- unknown
Top contributors by commit count, from the project’s public repository. Avatars are served by their origin, not stored here. To be removed from this list, open an issue.
Computed from shared tags, weighted so a rare tag counts for more than a common one. These are suggestions, not curated relationships.
- ASE_ANIcheminformatics · chemistry · neural-network
ANI-1 neural net potential with python interface (ASE)
- chempropchemistry · neural-network
Fast and scalable uncertainty quantification for neural molecular property prediction, accelerated optimization, and guided virtual screening.
- Chem-Faisscheminformatics · neural-network
This projects utilises vector similarity search from Faiss, in conjunction with chemical fingerprinting to build a scalabale similarity search architecture for compounds/molecules.
- asciiMolcheminformatics · chemistry
Curses based ASCII molecule viewer for terminals.
- atom-bond-featurizercheminformatics · chemistry
A Python package for the calculation of features and descriptors for atoms and bonds in molecules.
- bayesian-flow-network-for-chemistrycheminformatics · chemistry
ChemBFN: Bayesian Flow Network Framework for Chemistry Tasks. Developed in Hiroshima University.
- api.github.com/repos/ATOMScience-org/AMPLretrieved 2026-08-05 · via github-api
Machine-imported from GitHub search. Last push 2026-07-17, 149 stars, license reported as MIT. Category and schematic were assigned by keyword heuristics and are unreviewed.
Not yet verified by a human. Correct this record →
/v1/entries/47.json→ .entries["ampl"]
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