pubchem
Here are 54 public repositories matching this topic...
A convenient wrapper around PubChem PUG REST API that allows to search for many compound properties available at PubChem with ease
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Nov 30, 2017 - Python
NCBI PubChem to BEL
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May 1, 2019 - Python
PIDGIN Version 2: Prediction IncluDinG INactivity: Version 2 (LEGACY VERSION)
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Jul 19, 2019 - Python
Python library and command-line tool for extracting compounds from scientific literature. Written in Python.
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Jun 1, 2020 - Python
The start of making lab reports easier. Pull data from the PubChem API.
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Aug 27, 2020 - Python
This is a project that scrapes PubChem data for GHS hazard codes given CAS numbers
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Nov 7, 2021 - Jupyter Notebook
🥇Samsung AI Challenge 2021 1등 솔루션입니다🥇
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Nov 12, 2021 - Python
CH3mculator is a windows desktop application for stoichiometric calculations.
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Dec 8, 2022 - C#
Natural Language Processing
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Mar 14, 2023 - Jupyter Notebook
Rust data structures and client for the PubChem REST API
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Mar 20, 2023 - Rust
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.
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Jul 10, 2023 - JavaScript
Computational Drug Screening Platform
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Dec 20, 2023 - Python
Python client for PubChem's API to crawl compounds and their properties using a molecular formula search query.
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Feb 6, 2024 - Jupyter Notebook
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