Python script to scrape PubChem for chemical uses.
☆18Apr 24, 2019Updated 7 years ago
Alternatives and similar repositories for pubchemscrape
Users that are interested in pubchemscrape are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Utilities for interacting with PubChem☆17Feb 11, 2015Updated 11 years ago
- A convenient wrapper around PubChem PUG REST API that allows to search for many compound properties available at PubChem with ease☆28Nov 30, 2017Updated 8 years ago
- Utility to compile string of chemical terms into data structure with chemical formula and composition☆14Sep 17, 2021Updated 5 years ago
- ☆14Dec 26, 2024Updated last year
- ChemicalTagger is a tool for semantic text-mining in chemistry.☆46Jun 21, 2026Updated 3 months ago
- AI Agents on DigitalOcean Gradient AI Platform • AdBuild production-ready AI agents using customizable tools or access multiple LLMs through a single endpoint. Create custom knowledge bases or connect external data.
- Python interface to the ChemKED database format☆18Aug 4, 2026Updated last month
- A collection of transformer-based models and developmental scripts presented in the publication "Transformers enable accurate prediction …☆19Oct 3, 2025Updated 11 months ago
- Optimal facility location (Set Cover problem); setup costs and changeover times (traveling salesman problem) ; production and transportat…☆21Jul 9, 2018Updated 8 years ago
- Semi-supervised water storage retrieval using Sentinel-2☆18Jun 9, 2020Updated 6 years ago
- Julia-based framework for battery modelling☆16Jul 8, 2026Updated 2 months ago
- A Unified Language Model to Integrate Biomedical Text with 2D and 3D Molecular Representations☆26Jul 19, 2024Updated 2 years ago
- Implementation of various machine learning representations for molecules☆25Jan 7, 2022Updated 4 years ago
- A cheminformatics package to perform Applicability Domain of molecular fingerprints based in similarity calculation.☆28Feb 8, 2024Updated 2 years ago
- Utilities to programmatically query the PubChem database☆28Jun 26, 2026Updated 2 months ago
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- Some basic battery cell models written in Julia☆25Aug 27, 2021Updated 5 years ago
- Python code for the paper Bayesian Optimization of Nanoporous Materials.☆24Mar 3, 2023Updated 3 years ago
- Dataset and code for "Uncertainty-Informed Deep Transfer Learning of PFAS Toxicity"☆29Apr 24, 2023Updated 3 years ago
- Joint Optimization of Cascade Ranking Models (WSDM 19)☆13Jun 21, 2022Updated 4 years ago
- Official implementation for AAAI 2022 paper: "GeomGCL: Geometric Graph Contrastive Learning for Molecular Property Prediction".☆22Jul 11, 2022Updated 4 years ago
- Code for the Materials Scholar website☆10May 2, 2023Updated 3 years ago
- Antipasti-TF is a lightweight wrapper around Tensorflow for building convolutional neural networks with complex architechtures.☆16May 12, 2017Updated 9 years ago
- ☆12Oct 7, 2020Updated 5 years ago
- Codes and models for "Semi-supervised machine-learning classification of materials synthesis procedures". (https://doi.org/10.1038/s41524…☆10Apr 24, 2022Updated 4 years ago
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- test if the current network allows for direct p2p connections using upnp☆17Feb 1, 2016Updated 10 years ago
- An embedded Rust IDE with an emphasis on a fun and insightful coding experience☆11Sep 23, 2024Updated 2 years ago
- Spring 2023 seminar on automated experiment☆22Jun 12, 2023Updated 3 years ago
- ICLR 2026 | ChemEval: 4-level, 13-dimension, 62-task text/multimodal chemistry benchmark for evaluating LLMs and MLLMs.☆34Jun 9, 2026Updated 3 months ago
- Helps you select the optimal cell to electrify a long-haul truck from a database containing 160 cells.☆28Mar 8, 2023Updated 3 years ago
- reservoir: Tools for Analysis, Design, and Operation of Water Supply Storages☆29Jun 6, 2021Updated 5 years ago
- Learning sentiment-specific word representations from tweets☆15Nov 21, 2015Updated 10 years ago
- hierachical automation of the natural sciences☆26Feb 12, 2025Updated last year
- MGA☆44Jan 15, 2021Updated 5 years ago
- Virtual machines for every use case on DigitalOcean • AdGet dependable uptime with 99.99% SLA, simple security tools, and predictable monthly pricing with DigitalOcean's virtual machines, called Droplets.
- Paper notes for Information Extraction, including Relation Extraction (RE), Named Entity Recognition (NER), Entity Linking (EL), Event Ex…☆17Apr 1, 2021Updated 5 years ago
- BatteryBERT: A Pre-trained Language Model for Battery Database Enhancement☆37Sep 6, 2022Updated 4 years ago
- Python binding to the KrovetzStemmer package (C++ version)☆14Feb 12, 2023Updated 3 years ago
- BEEP: A Python Library for Battery Evaluation and Early Prediction. To cite this software publication: https://www.sciencedirect.com/scie…☆32May 16, 2020Updated 6 years ago
- KSP Plugin to automate highly efficient launches☆16May 12, 2019Updated 7 years ago
- ☆14Mar 8, 2025Updated last year
- A library to evaluate TREC-like runs with TREC-like qrels. Implements similarity of rankings, ttest between runs etc…☆19May 4, 2020Updated 6 years ago