R functions for the chemometric analysis of spectra
☆64Sep 9, 2025Updated 7 months ago
Alternatives and similar repositories for ChemoSpec
Users that are interested in ChemoSpec are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- R package: Misc. Functions for Processing and Sample Selection of Spectroscopic Data☆45Oct 17, 2025Updated 6 months ago
- Automated spectraL Processing System for NMR☆16Sep 24, 2025Updated 7 months ago
- resemble is an R package for similarity-based modelling and local learning in spectroscopy. It provides tools for dissimilarity computati…☆24Apr 21, 2026Updated last week
- FOSS Resources for Spectroscopy☆21Nov 25, 2025Updated 5 months ago
- 🌈 A collaborative list of awesome tools for spectroscopy. Also, check:☆132Aug 1, 2023Updated 2 years ago
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- Python package for reading Bruker OPUS files.☆66Sep 14, 2023Updated 2 years ago
- R package accompanying the second edition of "Chemometrics with R", Springer☆17Sep 2, 2020Updated 5 years ago
- Processes FTIR spectra of natural organic matter by finding exact peak locations, baseline-correcting the peaks, and converting them to r…☆11Aug 29, 2018Updated 7 years ago
- R implementation of advanced optimizers for torch☆26Jun 8, 2023Updated 2 years ago
- Workflow4Metabolomics meta repository☆11May 23, 2025Updated 11 months ago
- Reference OSSL calibration models fitting steps and tutorials☆16Feb 10, 2025Updated last year
- Read OPUS binary files from Fourier-Transform Infrared (FT-IR) spectrometers of the company Bruker Optics GmbH & Co. in base R☆22Apr 25, 2026Updated last week
- A deep-learning program, called fast fluorescent identification network (FFI-Net), is designed to fast identify the fluorescent component…☆22Mar 30, 2021Updated 5 years ago
- Python package for working with nucleic acid structural designs.☆16Apr 24, 2018Updated 8 years ago
- Serverless GPU API endpoints on Runpod - Get Bonus Credits • AdSkip the infrastructure headaches. Auto-scaling, pay-as-you-go, no-ops approach lets you focus on innovating your application.
- pyMCR: Multivariate Curve Resolution for Python☆95Oct 26, 2021Updated 4 years ago
- Deep-Learning-Based Components Identification for Raman Spectroscopy☆52Jan 3, 2020Updated 6 years ago
- Python code to identify and calculate decomposition of materials using Raman spectroscopy☆30Dec 31, 2020Updated 5 years ago
- Analyze, Process, Identify, and Share, Raman and (FT)IR Spectra☆37Mar 6, 2026Updated last month
- Python software for spectral data processing (IR, Raman, XAS...)☆254Mar 30, 2026Updated last month
- Metabolomics Tools for Galaxy☆21Nov 22, 2016Updated 9 years ago
- SpectroChemPy is a framework for processing, analyzing and modeling spectroscopic data for chemistry with Python☆166Updated this week
- R package for multiblock analyses☆18Apr 1, 2025Updated last year
- DLL and SO from Bruker.☆12Feb 25, 2026Updated 2 months ago
- Managed Kubernetes at scale on DigitalOcean • AdDigitalOcean Kubernetes includes the control plane, bandwidth allowance, container registry, automatic updates, and more for free.
- ☆14Mar 28, 2019Updated 7 years ago
- Integrate your chemometric tools with the scikit-learn API 🧪 🤖☆74Updated this week
- A repo for community contributed demos and how-tos to get common stuff done in the R language☆30Mar 12, 2024Updated 2 years ago
- Shiny app for retention time prediction☆11Dec 1, 2025Updated 5 months ago
- hyperSpec: Tools for Spectroscopy (R package)☆20Apr 2, 2026Updated last month
- pyChemometrics - Objects for multivariate analysis of chemometric and metabonomic datasets☆40Apr 5, 2025Updated last year
- R package for Multivariate Data Analysis☆40Mar 6, 2026Updated last month
- Repo hosting the MetFrag website☆10Apr 6, 2026Updated 3 weeks ago
- ☆16Nov 26, 2021Updated 4 years ago
- GPUs on demand by Runpod - Special Offer Available • AdRun AI, ML, and HPC workloads on powerful cloud GPUs—without limits or wasted spend. Deploy GPUs in under a minute and pay by the second.
- Quantity Calculus for R Vectors☆27Dec 15, 2025Updated 4 months ago
- Implementation of the Data-Driven SIMCA method for MATLAB☆10Mar 30, 2021Updated 5 years ago
- A python package for communicating with Bruker OPUS spectroscopy software and reading its binary file format.☆35Nov 14, 2025Updated 5 months ago
- R package for MetaboAnalyst☆393Updated this week
- Handling and analysis of Vis-NIR spectra in R☆12Oct 19, 2025Updated 6 months ago
- A Comprehensive Software for Data Mining and Multivariate Analysis☆17Apr 22, 2026Updated last week
- MeSH Enrichment and Semantic analyses☆12Updated this week