There are 2 repositories under pubchem topic.
🥇Samsung AI Challenge 2021 1등 솔루션입니다🥇
A convenient wrapper around PubChem PUG REST API that allows to search for many compound properties available at PubChem with ease
chemical identifiers (CAS, PubChemID, SMILES,InChI, InChI keys, names) from text search
Bioclipse Cheminformatics Feature
NXOntology data: making ontologies accessible as simple JSON files
Rust data structures and client for the PubChem REST API
Tool for finding similar chemical compounds based on their smiles representation
This is a project that scrapes PubChem data for GHS hazard codes given CAS numbers
helping data and metadata travel between PubChem and Wikidata
Computational Drug Screening Platform
A collection of Alfred workflows
Natural Language Processing
Use machine learning to harness prediction of chemicals adsorption on adsorbent materials, using data from the NIST/ARPA-E Database of Novel and Emerging Adsorbent Materials
Python client for PubChem's API to crawl compounds and their properties using a molecular formula search query.
KEGG-Chem is a Python program designed to retrieve KEGG compounds and associated data using an input of KEGG orthologues or modules, and can also retrieve SMILES, SDF files, and more from PubChem.
The start of making lab reports easier. Pull data from the PubChem API.
CH3mculator is a windows desktop application for stoichiometric calculations.
A Web App that allows the user to search for 2D & 3D structure of over 100 million Compounds, get briefed about the constituent elements of the compound in an organized periodic table.