CambridgeMolecularEngineering / chemdataextractorLinks
Pipeline for automated extraction of chemical property information from scientific documents
☆19Updated 7 years ago
Alternatives and similar repositories for chemdataextractor
Users that are interested in chemdataextractor are comparing it to the libraries listed below
Sorting:
- Extracts data from tables with complicated structures.☆16Updated 7 months ago
- RXN fork of OpenNMT-py - Open Source Neural Machine Translation in PyTorch☆26Updated last year
- Chemistry-related Python utilities used in the RXN universe☆25Updated last year
- An open-source effort towards accessible polymer data☆39Updated 4 years ago
- Contrastive pretraining to learn chemical reaction representations (RxnRep) for downstream tasks.☆34Updated 3 years ago
- ☆34Updated 3 months ago
- Hierarchical template correction for chemical reactions☆17Updated last year
- A smile is all you need: Predicting limiting activity coefficients from SMILES with natural language processing☆23Updated last year
- ☆17Updated 4 years ago
- Python wrapper for OSRA. Supports R-Group logic and integration with ChemSchematicResolver☆10Updated 5 years ago
- Input- hand-drawn image of molecule... Output- SMILES format molecule name☆16Updated 6 years ago
- Prediction molecular structure from NMR spectra☆34Updated last year
- A dataset of Curie temperatures automatically extracted from scientific literature with the use of the BERT-PSIE pipeline☆15Updated 2 years ago
- ChemicalTagger is a tool for semantic text-mining in chemistry.☆43Updated 2 months ago
- ☆15Updated 3 years ago
- GitHub Repository for "Sigma Profiles in Deep Learning: Towards a Universal Molecular Descriptor"☆12Updated last year
- Automagically resolve the best structure for molecules across several databases from identifiers☆32Updated last month
- Generate 3D transition state geometries with GNNs☆15Updated 5 years ago
- Python program for modelling and simulating polymers.☆39Updated 3 weeks ago
- Chemical reaction data cleaning☆30Updated 3 years ago
- ☆13Updated 4 years ago
- ☆14Updated 11 months ago
- Extracts tables into json format from HTML/XML files☆37Updated 5 years ago
- Python toolkit for resolving chemical schematic diagrams.☆42Updated 5 years ago
- ☆16Updated 4 months ago
- A Molecular Stereostructure Descriptor based on Spherical Projection☆13Updated last year
- Generate Boltzmann-weighted Sterimol Steric Parameters for Conformationally-Flexible Substituents☆29Updated 3 years ago
- The Block Copolymer Phase Behavior Database (BCDB)☆20Updated last year
- Action sequence prediction for arbitrary chemical equations☆26Updated 4 years ago
- ☆12Updated 6 years ago