Alternatives and similar repositories for molDiscovery

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

• oolonek / ISDB
  A database of In-Silico predicted MS/MS spectrum of Natural Products
  ☆14Updated 2 years ago
• zmahnoor14 / MAW
  Metabolome Annotation Workflow
  ☆25Updated last year
• pnnl / MSAC
  ☆23Updated last month
• merlin-ms / awesome-mass-spectral-libraries
  ☆18Updated last year
• ipb-halle / MetFragRelaunched
  Relaunch of the initial MetFrag project.
  ☆18Updated this week
• bittremieux-lab / falcon
  Large-scale tandem mass spectrum clustering using fast nearest neighbor searching.
  ☆28Updated 2 months ago
• pnnl / deimos
  ☆33Updated 2 months ago
• YuanyueLi / FlashEntropySearch
  Flash entropy search
  ☆14Updated last year
• computational-metabolomics / msPurity
  R-package - Automated Evaluation of Precursor Ion Purity for Mass Spectrometry Based Fragmentation in Metabolomics
  ☆16Updated last year
• lkytal / PredFull
  This work was published on Analytical Chemistry: Full-Spectrum Prediction of Peptides Tandem Mass Spectra using Deep Neural Network
  ☆29Updated last year
• eMetaboHUB / FragHub
  ☆12Updated last week
• shuzhao-li-lab / PythonCentricPipelineForMetabolomics
  Python pipeline for metabolomics data preprocessing, QC, standardization and annotation
  ☆14Updated 5 months ago
• XiminHu / mass-suite
  ☆25Updated last year
• matchms / ms2deepscore
  Deep learning similarity measure for comparing MS/MS spectra with respect to their chemical similarity
  ☆60Updated 2 months ago
• madeleineernst / pyMolNetEnhancer
  ☆20Updated last year
• HuanLab / BUDDY
  Bottom-up MS/MS interrogation & Experiment-specific global annotation
  ☆28Updated 4 months ago
• OpenMS / pyopenms_viz
  Streamlining Mass Spectrometry Data Visualization with Pandas
  ☆14Updated 2 weeks ago
• meowcat / MSNovelist
  ☆63Updated 8 months ago
• kaibioinfo / canopus_treemap
  CANOPUS visualization for Jupyter notebook
  ☆20Updated 3 years ago
• mwang87 / NP-Classifier
  ☆23Updated 7 months ago
• WMBEdmands / compMS2Miner
  metabolite identification R-package for metabolomic high-resolution LC-MS datasets.
  ☆14Updated 8 years ago
• MRMkit / MRMkit
  ☆9Updated 3 weeks ago
• Philipbear / msbuddy
  a python package for molecular formula analysis in MS-based small molecule studies
  ☆27Updated 2 months ago
• idslme / IDSL_MINT
  A Deep Learning Framework to Interpret Raw Mass Spectrometry (m/z) Data
  ☆23Updated last year
• LeidelLab / SMITER
  Synthetic mzML writer
  ☆13Updated 2 months ago
• Elizachem / SMRT_transfer
  ☆10Updated 3 years ago
• HuanLab / ISFrag
  A bioinformatic tool facilitating automated in-source fragmentation identification
  ☆10Updated 2 years ago
• iomega / ms2query
  MS2Query - machine learning assisted library querying of MS/MS spectra
  ☆44Updated 7 months ago
• mwang87 / MassQueryLanguage
  The Mass Spec Query Language (MassQL) is a domain specific language meant to be a succinct way to express a query in a mass spectrometry …
  ☆40Updated 5 months ago
• zhanghailiangcsu / MSBERT
  Improve the accuracy of database search by using BERT to embed MS/MS reasonably
  ☆18Updated 7 months ago