Various Cheminformatic, Curation and Mass Spectrometry Functions
☆15Jan 15, 2021Updated 5 years ago
Alternatives and similar repositories for RChemMass
Users that are interested in RChemMass are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- This is the git repository matching the Bioconductor package mzR: parser for netCDF, mzXML, mzData and mzML files (mass spectrometry data…☆46Mar 31, 2026Updated 2 months ago
- OpenBabel wrapper package for R☆10Mar 12, 2026Updated 3 months ago
- Load mass spectrometry mzXML files☆18Jul 14, 2022Updated 3 years ago
- Workflow solutions for mass-spectrometry based non-target analysis.☆76Updated this week
- Package to analyze Mass Spec Data☆12Aug 24, 2023Updated 2 years ago
- Wordpress hosting with auto-scaling - Free Trial Offer • AdFully Managed hosting for WordPress and WooCommerce businesses that need reliable, auto-scalable performance. Cloudways SafeUpdates now available.
- Tools for analysis of Mass Spectrometry data using the Wasserstein metric☆19May 26, 2026Updated 3 weeks ago
- data structures for chemistry in R☆19Sep 3, 2021Updated 4 years ago
- Code for KekuleScope☆11Nov 22, 2022Updated 3 years ago
- ☆12Jul 10, 2022Updated 3 years ago
- A Python wrapper for the Chemistry Development Kit (CDK)☆38Sep 9, 2025Updated 9 months ago
- ☆13Jul 30, 2018Updated 7 years ago
- Distributed matrix classes and methods for the pbdR project.☆17Sep 29, 2024Updated last year
- The Database Infrastructure for Mass Spectrometry (DIMSpec) project☆26Jun 27, 2025Updated 11 months ago
- Talking to Docker and Singularity containers☆24Dec 27, 2023Updated 2 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.
- ErtlFunctionalGroupsFinder for CDK☆19Dec 18, 2023Updated 2 years ago
- Integrating R and the CDK☆44Nov 30, 2025Updated 6 months ago
- Visualization of multiple tandem mass spectrometry data☆10Jun 15, 2020Updated 6 years ago
- Automatically exported from code.google.com/p/semanticchemistry☆10Mar 7, 2021Updated 5 years ago
- R package for MetFrag☆24Sep 25, 2017Updated 8 years ago
- An modular and extensible app for visualization of mass spectrometry data and optimization of data acquisition.☆27May 3, 2026Updated last month
- Mass spectrometry data visualization☆38Nov 30, 2020Updated 5 years ago
- ☆13Jul 11, 2017Updated 8 years ago
- ☆17Mar 11, 2023Updated 3 years ago
- End-to-end encrypted cloud storage - Proton Drive • AdSpecial offer: 40% Off Yearly / 80% Off First Month. Protect your most important files, photos, and documents from prying eyes.
- R package for supporting exploratory graphics at http://opensource.nibr.com/xgx☆16Jul 12, 2025Updated 11 months ago
- https://taxonomicallyinformedannotation.github.io/tima☆16Updated this week
- Compile Mass Spectral Libraries from Various Sources☆18May 3, 2024Updated 2 years ago
- Applications using AMBIT and examples how to call AMBIT modules☆15Feb 19, 2022Updated 4 years ago
- A simple author handler for scientific writing☆22Jan 3, 2026Updated 5 months ago
- Event Prediction in Clinical Trials with Time-to-Event Outcomes☆14May 12, 2017Updated 9 years ago
- chemmodlab: A Cheminformatics Modeling Laboratory for Fitting and Assessing Machine Learning Models☆17Nov 20, 2025Updated 6 months ago
- ☆17Jan 10, 2026Updated 5 months ago
- Scalable and self-optimizing processing workflow for untargeted LC-MS☆33Aug 3, 2024Updated last year
- Wordpress hosting with auto-scaling - Free Trial Offer • AdFully Managed hosting for WordPress and WooCommerce businesses that need reliable, auto-scalable performance. Cloudways SafeUpdates now available.
- Tool for mining structure-property relationships from chemical datasets☆16May 5, 2026Updated last month
- TidyMS: Tools for working with MS data in untargeted metabolomics☆62Jul 13, 2024Updated last year
- Plotting utilities for mass spectrometry data☆10Apr 26, 2021Updated 5 years ago
- Faster manipulation of dendrogram objects in R.☆15May 22, 2015Updated 11 years ago
- R-based access to Mass-Spectrometry data☆25Sep 17, 2025Updated 8 months ago
- A set of custom visualisations built on top of JSViz☆11Jan 7, 2023Updated 3 years ago
- A mass spectrometry package for Julia☆11Jun 5, 2026Updated last week