def-fun / molOCRLinks
基于osra的化学结构式识别工具
☆19Updated last year
Alternatives and similar repositories for molOCR
Users that are interested in molOCR are comparing it to the libraries listed below
Sorting:
- ☆16Updated 4 years ago
- ☆24Updated 3 years ago
- Chainer implementation of Graph Neural Networks for the Prediction of Substrate-Specific Organic Reaction Conditions☆10Updated 4 years ago
- ☆13Updated 4 years ago
- Molecular SMILE generation with recurrent neural networks☆21Updated 6 months ago
- Cross-model Retrieval between 13C NMR Spectrum and Structure☆20Updated 4 years ago
- This repository contains RanDepict, an easy-to-use utility to generate a big variety of chemical structure depictions (random depiction s…☆29Updated 2 years ago
- ☆17Updated 4 years ago
- Python wrapper for OSRA. Supports R-Group logic and integration with ChemSchematicResolver☆10Updated 5 years ago
- Python library and command-line tool for extracting compounds from scientific literature. Written in Python.☆47Updated 5 years ago
- ☆11Updated 7 years ago
- Pipeline for automated extraction of chemical property information from scientific documents☆19Updated 7 years ago
- ☆13Updated 6 years ago
- Command line tool providing BOSS generated OPLS-AA/CM1A(-LBCC) parameters for organic molecules and ligands.☆11Updated 8 years ago
- Metal Activity Heuristic of Metalloprotein and Enzymatic Sites (MAHOMES) - Predicts if a protein bound metal ion is enzymatic or non-enzy…☆11Updated 3 years ago
- Test data for paper “αExtractor: a web server for automatic extraction of chemical structure from literature”☆16Updated 2 years ago
- Given an image of a molecule create a smiles or mol represenatation.☆25Updated 4 years ago
- a universal machine learning model for predicting properties of Chemical Compounds☆11Updated 6 years ago
- Parallelized Open Babel & Autodock suite Pipeline☆24Updated 7 years ago
- ☆12Updated 3 years ago
- Energy-based modeling of chemical reactions☆34Updated 3 years ago
- ☆12Updated 7 years ago
- Chemistry-related Python utilities used in the RXN universe☆25Updated last year
- Action sequence prediction for arbitrary chemical equations☆26Updated 4 years ago
- Img2SMILES generator☆25Updated 4 years ago
- Tools, tutorials, and wiki for GROMACS☆20Updated 5 years ago
- This repository contains the information related to the benchmark study on openly available OCSR tools☆43Updated 4 years ago
- Data and model repository for the ASKCOS application☆16Updated 3 years ago
- Extracts data from tables with complicated structures.☆16Updated 10 months ago
- A feeble attempt at molecular recognition (in the literal sense)☆66Updated last year