CH3mculator is a windows desktop application for stoichiometric calculations.
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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.
This repository contains Jonathan et al.'s AoL (Assurance of Learning) Project for SCIE6062001 - Computational Biology Course.
Python client for PubChem's API to crawl compounds and their properties using a molecular formula search query.
chemistry and medicine datasheet library
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
Natural Language Processing
Computational Drug Screening Platform
A collection of Alfred workflows
Chemical Properties Relation Extraction
This is a project that scrapes PubChem data for GHS hazard codes given CAS numbers
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