CambridgeMolecularEngineering / chemdataextractor2
ChemDataExtractor Version 2.0
☆148Updated this week
Alternatives and similar repositories for chemdataextractor2:
Users that are interested in chemdataextractor2 are comparing it to the libraries listed below
- Extracts tables into json format from HTML/XML files☆35Updated 4 years ago
- Chemical structure detection and segmentation tool for Journal articles.☆100Updated this week
- Universal Transfer Learning in Porous Materials, including MOFs.☆94Updated 9 months ago
- Extracts data from tables with complicated structures.☆15Updated last week
- A benchmark dataset for polymer informatics.☆59Updated 3 years ago
- Codes for text-mined solid-state reactions dataset☆74Updated last year
- ☆67Updated 8 months ago
- molSimplify code☆183Updated this week
- Example scripts using the CSD Python API☆71Updated this week
- Transformer-based model for chemical reactions☆73Updated 3 months ago
- Gromacs to Lammps simulation converter☆74Updated last year
- ChatGPT Chemistry Assistant☆81Updated last year
- The functions of superalloyDigger toolkit include batch downloading documents in XML and TXT format from the Elsevier database, locating …☆55Updated 8 months ago
- A python package for chemical space visualization.☆139Updated 3 months ago
- This repository contains the code for https://decimer.ai☆42Updated last year
- ChemNLP: A Natural Language Processing based Library for Materials Chemistry Text Data☆74Updated 7 months ago
- polyBERT: A chemical language model to enable fully machine-driven ultrafast polymer informatics☆49Updated 6 months ago
- EDBO+. Bayesian reaction optimization as a tool for chemical synthesis.☆68Updated last month
- Reliable explanation and ways to solve the error messages for the Gaussian quantum chemistry program. This is a per request English trans…☆73Updated last year
- A public repository collecting links to state of the art QA and evaluation sets for various ML and LLM applications☆89Updated 8 months ago
- Toolkit for Chemical Reaction Extraction from Scientific Literature (JCIM 2021)☆73Updated 2 years ago
- EPFL CH-457 "AI for chemistry"☆172Updated this week
- ☆62Updated 3 months ago
- Ionic liquid force field parameters (OPLS-2009IL and OPLS-VSIL)☆58Updated 7 months ago
- automated reaction profile generation☆176Updated last month
- ☆28Updated 7 months ago
- Python wrapper for the IBM RXN for Chemistry API☆188Updated 10 months ago
- Two algorithms to fragment molecules into specified molecular subunits (e.g. functional groups)☆21Updated 3 weeks ago
- Tool for the canonicalization of Polymer SMILES (P🙂) strings☆21Updated 6 months ago
- A system for rapid identification and analysis of metal-organic frameworks☆51Updated 3 months ago