lyn1874 / raman_spectra_matching_with_contrastive_learning
Official implementation for paper "Raman spectra matching with contrastive representation learning"
☆15Updated 2 years ago
Alternatives and similar repositories for raman_spectra_matching_with_contrastive_learning:
Users that are interested in raman_spectra_matching_with_contrastive_learning are comparing it to the libraries listed below
- Component Identification with Raman Spectroscopy Made Easy☆14Updated 2 months ago
- Patch-based Convlutional Encoder for vibrational spectrum recognition☆11Updated 6 months ago
- Generator useful to handle Raman spectra data augmentation for deep learning models☆24Updated last year
- A fast and efficient spectra standardization algorithm.☆11Updated 5 years ago
- Python package that provides a full range of functionality to process and analyze vibrational spectra (Raman, SERS, FTIR, etc.).☆64Updated 6 months ago
- ☆10Updated 2 years ago
- ☆15Updated 3 years ago
- ☆22Updated 2 years ago
- Framework for Raman spectroscopy analysis☆13Updated 10 months ago
- Source code of the paper "Prediction of Molecular Absorption Wavelength Using Deep Neural Networks"☆9Updated 2 years ago
- python toolkit for calibration of near infrared ( NIR) spectra☆13Updated 3 months ago
- allows MAGMa metabolite identification with dynamic parameter selection☆9Updated 5 years ago
- A Universal and Accurate Method for Easily Component identification in Raman Spectroscopy Based on Deep Learning☆29Updated 6 months ago
- This package is a python warpper for CFM-ID☆11Updated 2 years ago
- ☆12Updated last year
- [Bioinformatics] 3DMolMS: prediction of tandem mass spectra from 3D molecular conformations☆21Updated 2 weeks ago
- Especially useful for preprocessing of datasets like Raman spectra, infrared spectra, UV/Vis spectra, but also HPLC data and many other t…☆16Updated 2 weeks ago
- Deep learning for molecules quantum chemistry properties prediction☆38Updated 3 years ago
- ☆17Updated last year
- Graph based Reaction Template Extraction☆21Updated last week
- Generator of SMILES string from bigSMILES with extension☆19Updated this week
- Deep Learning for Chemical Image Recognition (DECIMER)☆18Updated 3 years ago
- Deep Convolutional Neural Networks for Raman Spectrum Recognition. (RRUFF dataset)☆31Updated 4 years ago
- This repo contains demonstrations of an extensible Crystal Structure Type Recognition Network (CSTRNet), which consists of a variable num…☆10Updated 10 months ago
- Source code and demos for "Rapid identification of pathogenic bacteria using Raman spectroscopy and deep learning"☆98Updated 5 years ago
- ☆20Updated 4 years ago
- Python wrapper for OSRA. Supports R-Group logic and integration with ChemSchematicResolver☆10Updated 4 years ago
- Chemometric analysis methods implemented in python☆11Updated 2 months ago
- Highly accurate and large-scale collision cross section prediction with graph neural network for compound identification☆16Updated last year
- ☆22Updated last year