AutoChem
importedtherapeutics/autochem
Virtual Chemical Reactor and scripts for automated quantum chemistry calculations
Machine-generated from the listed sources and not yet reviewed by a human.
- Category
- Therapeutics
- Subcategory
- unknown
- License
- MIT(osi)
- Status
- maintained
- Maturity
- deployed
- Organization
- unknown
- Country
- unknown
- Homepage
- unknown
- Repository
- github.com/Daniele-Dondi/AutoChem
- Documentation
- unknown
- Tags
- cheminformatics · chemistry · chemistry-development-kit · dft-calculations · orca-quantum-chemistry · quantum-chemistry
- Regulatory
- unknown
Computed from shared tags, weighted so a rare tag counts for more than a common one. These are suggestions, not curated relationships.
- cdkbookcheminformatics · chemistry · chemistry-development-kit
Groovy Cheminformatics with the Chemistry Development Kit
- cheminformatics-microservicecheminformatics · chemistry · chemistry-development-kit
This set of essential and valuable microservices is designed to be accessed via API calls to support cheminformatics.
- pyCheckmolcheminformatics · chemistry · chemistry-development-kit
Application for detecting functional groups of a molecules.
- SpectraFPcheminformatics · chemistry · chemistry-development-kit
A package to perform fingerprints from spectroscopy datas.
- psikitcheminformatics · chemistry · quantum-chemistry
psi4+RDKit
- pySiRCcheminformatics · chemistry · quantum-chemistry
Simple web application for prediction of reaction rate constant through machine learning models using molecular fingerprints.
- api.github.com/repos/Daniele-Dondi/AutoChemretrieved 2026-08-25 · via github-api
Machine-imported from GitHub search. Last push 2025-12-21, 11 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/55.json→ .entries["autochem"]
Entries are sharded 64 ways by a stable hash of the id, so a consumer can find any record without an index.