CambridgeMolecularEngineering / tabledataextractor
Extracts data from tables with complicated structures.
☆13Updated 2 years ago
Related projects ⓘ
Alternatives and complementary repositories for tabledataextractor
- This repo contains ReactionDataExtractor v.2 - software toolkit for extraction of information from chemical reaction schemes☆19Updated last year
- The Block Copolymer Phase Behavior Database (BCDB)☆16Updated 8 months ago
- Python toolkit for resolving chemical schematic diagrams.☆37Updated 4 years ago
- ☆28Updated 3 years ago
- Fun with P🙂s strings - canonicalize, randomize, dimerize, fingerprint☆26Updated 2 months ago
- Tool for the canonicalization of Polymer SMILES (P🙂) strings☆19Updated 2 months ago
- An open-source effort towards accessible polymer data☆32Updated 3 years ago
- Extracts tables into json format from HTML/XML files☆35Updated 4 years ago
- ChemNLP: A Natural Language Processing based Library for Materials Chemistry Text Data☆73Updated 3 months ago
- Chemistry-related Python utilities used in the RXN universe☆21Updated 4 months ago
- ☆28Updated 3 months ago
- Machine learning exercises for the MolSim course (http://www.acmm.nl/molsim/molsim2023/index.html)☆24Updated 10 months ago
- Prediction molecular structure from NMR spectra☆17Updated 8 months ago
- Generate Boltzmann-weighted Sterimol Steric Parameters for Conformationally-Flexible Substituents☆28Updated 2 years ago
- Language-interfaced fine-tuning for chemistry☆32Updated 11 months ago
- Contrastive pretraining to learn chemical reaction representations (RxnRep) for downstream tasks.☆31Updated 2 years ago
- Simple Python interface to OPSIN: Open Parser for Systematic IUPAC nomenclature☆43Updated last week
- Software for the text mining of the synthesis method, solvent, topology, organic linker, and metal precursor of metal-organic frameworks.☆18Updated 2 years ago
- An NLP-inspired chemical reaction fingerprint based on basic set arithmetic.☆61Updated last year
- Example scripts using the CSD Python API☆60Updated last week
- Code to support the paper: P. van Gerwen, K. R. Briling, C. Bunne, V. R. Somnath, R. Laplaza, A. Krause, C. Corminboeuf, "3DReact: Geomet…☆18Updated 4 months ago
- ☆47Updated 4 months ago
- Action sequence prediction for arbitrary chemical equations☆26Updated 3 years ago
- ☆23Updated 2 months ago
- Toolkit for Chemical Reaction Extraction from Scientific Literature (JCIM 2021)☆72Updated 2 years ago
- LimeSoup is a package to parse HTML or XML papers from different publishers.☆19Updated 3 years ago
- A benchmark dataset for polymer informatics.☆55Updated 3 years ago
- Message Passing Neural Networks for Molecule Property Prediction☆37Updated 2 years ago
- ChatGPT Chemistry Assistant☆76Updated last year
- CGRs, molecules and reactions manipulation☆43Updated 2 years ago