Python wrapper for the PubChem PUG REST API.
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Apr 12, 2024 - Python
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pubchem
Here are 37 public repositories matching this topic...
🥇Samsung AI Challenge 2021 1등 솔루션입니다🥇
competition deep-learning molecular-structures pytorch transformer samsung pubchem molecular dacon pytorch-lightning wandb deberta molecular-property-prediction pubchemqc
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Nov 12, 2021 - Python
Python library and command-line tool for extracting compounds from scientific literature. Written in Python.
python natural-language-processing named-entity-recognition pdf-files pubchem chemspider ner extract-entities chemical-entities ocsr
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Jun 1, 2020 - Python
PIDGIN Version 2: Prediction IncluDinG INactivity: Version 2 (LEGACY VERSION)
cheminformatics random-forest molecule target weight pubchem chemoinformatics target-predictions target-prediction
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Jul 19, 2019 - Python
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
chemical identifiers (CAS, PubChemID, SMILES,InChI, InChI keys, names) from text search
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Nov 23, 2024 - Julia
NXOntology data: making ontologies accessible as simple JSON files
python taxonomies graphs networkx obo networks pubchem ontologies hierarchies network-biology nxontology
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Dec 1, 2024 - Jupyter Notebook
Rust data structures and client for the PubChem REST API
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Mar 20, 2023 - Rust
NCBI PubChem to BEL
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May 1, 2019 - Python
Tool for finding similar chemical compounds based on their smiles representation
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Dec 8, 2022 - Python
This is a project that scrapes PubChem data for GHS hazard codes given CAS numbers
os requests cas tkinter scrape pubchem regular-expressions dataframe ncbi chemicals beautifulsoup4 pandas-python ghs hazards
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Nov 7, 2021 - Jupyter Notebook
Light-weight browser extension to copy random molecule data from trusted sources that can be used by scientists and enthusiasts alike.
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Apr 6, 2024 - Svelte
A collection of Alfred workflows
macos alfred alfred-workflow fritzbox smart-home pubchem simpsons devonagent pubchem-database molar-mass
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Dec 1, 2024 - Shell
Empowering Drug Research with AI and Collaboration
javascript typescript ai nextjs neon chartjs postgresql nvidia rdkit pubchem resend prisma tailwind tailwindcss
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Sep 8, 2024 - TypeScript
Quickly find chemical information using the PubChem API
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Jul 31, 2024 - Python
Natural Language Processing
python disease pubchem punkt smiles nlp-machine-learning article-extractor nltk-python phytocompounds
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Mar 14, 2023 - Jupyter Notebook
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