CH3mculator is a windows desktop application for stoichiometric calculations.
-
Updated
Dec 8, 2022 - C#
CH3mculator is a windows desktop application for stoichiometric calculations.
The start of making lab reports easier. Pull data from the PubChem API.
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.
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.
Python client for PubChem's API to crawl compounds and their properties using a molecular formula search query.
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
Drug Discovery model targeting the SARS coronavirus
A collection of Alfred workflows
Natural Language Processing
Computational Drug Screening Platform
This is a project that scrapes PubChem data for GHS hazard codes given CAS numbers
Light-weight browser extension to copy random molecule data from trusted sources that can be used by scientists and enthusiasts alike.
Add a description, image, and links to the pubchem topic page so that developers can more easily learn about it.
To associate your repository with the pubchem topic, visit your repo's landing page and select "manage topics."