Alternatives and similar repositories for ChemmineR

Users that are interested in ChemmineR are comparing it to the libraries listed below

• CDK-R / cdkr
  Integrating R and the CDK
  ☆44Updated last year
• nanxstats / Rcpi
  💊 Molecular informatics toolkit with integration of bioinformatics and cheminformatics tools for drug discovery
  ☆37Updated 11 months ago
• wkumler / RaMS
  R-based access to Mass-Spectrometry data
  ☆24Updated last month
• swsoyee / r3dmol
  🧬 An R package for visualizing molecular data in 3D
  ☆91Updated last year
• rformassspectrometry / MetaboAnnotation
  High level functionality to support and simplify metabolomics data annotation.
  ☆16Updated 3 months ago
• nanxstats / protr
  🧬 Toolkit for generating various numerical features of protein sequences
  ☆53Updated this week
• rformassspectrometry / metaRbolomics-book
  The MetaRbolomics book. A review of R packages in BioC, CRAN, gitlab and github.
  ☆33Updated 4 years ago
• aberHRML / classyfireR
  R Interface to the ClassyFire REST API
  ☆11Updated 6 months ago
• ipb-halle / MetFragR
  R package for MetFrag
  ☆24Updated 7 years ago
• rformassspectrometry / Spectra
  Low level infrastructure to handle MS spectra
  ☆41Updated last week
• jorainer / SpectraTutorials
  These workshops and tutorials provide use cases and examples for mass spectrometry data handling and analysis using the Spectra Bioconduc…
  ☆21Updated last year
• rickhelmus / patRoon
  Workflow solutions for mass-spectrometry based non-target analysis.
  ☆66Updated last week
• barupal / ChemRICH
  Chemical Similarity Enrichment analysis of metabolomics datasets
  ☆29Updated last year
• pattilab / DecoID
  Metabolomics software for database-assisted deconvolution of MS/MS spectra
  ☆19Updated last year
• USEPA / CompTox-ToxCast-tcpl
  US EPA's Toxicity Forecaster (ToxCast) Pipeline. More information on the ToxCast program available here: https://www.epa.gov/comptox-tool…
  ☆38Updated last week
• yufree / xcmsrocker
  Rocker image for metabolomics data analysis
  ☆13Updated 2 months ago
• schymane / RChemMass
  Various Cheminformatic, Curation and Mass Spectrometry Functions
  ☆14Updated 4 years ago
• rietho / IPO
  A Tool for automated Optimization of XCMS Parameters
  ☆34Updated 2 years ago
• mjhelf / Metaboseek
  Interactive software to analyze and browse mass spectrometry data
  ☆21Updated last month
• pmartR / pmartR
  The pmartR R package provides functionality for quality control, normalization, exploratory data analysis, and statistical analysis of ma…
  ☆46Updated 3 weeks ago
• wilsontom / msconverteR
  Create .mzML files through the R Console
  ☆11Updated 2 weeks ago
• OrgMassSpec / OrgMassSpecR
  Organic/biological mass spectrometry data analysis (development version).
  ☆30Updated 8 years ago
• zmahnoor14 / MAW
  Metabolome Annotation Workflow
  ☆25Updated last year
• jpquast / protti
  Picotti lab data analysis package.
  ☆64Updated 4 months ago
• yufree / enviGCMS
  GC/LC-MS data analysis for environmental science
  ☆17Updated 3 months ago
• rformassspectrometry / RforMassSpectrometry
  The R for Mass Spectrometry meta-package
  ☆17Updated last year
• dgrapov / CTSgetR
  R interface to Chemical Translation Service (CTS)
  ☆16Updated last year
• sgibb / MALDIquant
  Quantitative Analysis of Mass Spectrometry Data
  ☆67Updated last year
• ODonnell-Lipidomics / LipidFinder
  LipidFinder: A computational workflow for discovery of new lipid molecular species
  ☆20Updated 4 years ago
• pauca / RRDKit
  A pragmatic interface to RDKit in R
  ☆25Updated 5 years ago