Alternatives and similar repositories for pynir

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

• Brandt-J / SpectraReconstruction
  ☆13Updated 3 years ago
• mahynski / pychemauth
  Chemometric analysis methods implemented in python
  ☆13Updated 2 months ago
• Ryan21wy / EasyCID
  Component Identification with Raman Spectroscopy Made Easy
  ☆16Updated 8 months ago
• MarklandGroup / NMR2Struct
  NMR structure elucidation
  ☆14Updated 3 months ago
• Charisma-Mannheim / gc-ims-tools
  Python package to handle and analyze GC-IMS data.
  ☆17Updated last week
• Omicometrics / pypls
  Implementation of PLS-DA and OPLS-DA for high dimensional data, like MS in metabolomics.
  ☆35Updated 3 months ago
• zhengfj1994 / PPGB_MS2
  ☆11Updated 10 months ago
• EBjerrum / Deep-Chemometrics
  Using deep learning approaches and convolutional neural networks (CNN) for spectroscopical data (deep chemometrics)
  ☆75Updated 6 years ago
• hcji / PyCFMID
  This package is a python warpper for CFM-ID
  ☆13Updated 3 years ago
• HopkinsLaboratory / Graphormer-IR
  Graphormer-IR is an extension of the Graphormer framework, specifically to perform predictions of infrared spectra using only chemical st…
  ☆11Updated 4 months ago
• maruedt / chemometrics
  Python library for chemometric data analysis
  ☆34Updated 2 years ago
• AberystwythSystemsBiology / pyISOPACh
  A "fairly fast" ISOtope PAttern Calculator for Python
  ☆11Updated 2 years ago
• AbnerEdwards / successive-projections-algorithm-SPA
  ☆12Updated 3 years ago
• XiaqiongFan / PC-CCA
  A fast and efficient spectra standardization algorithm.
  ☆11Updated 6 years ago
• PHOENIXcenter / deeprtalign
  a deep learning-based retention time alignment tool for large cohort LC-MS data analysis
  ☆13Updated last year
• WJmodels / CMGNet
  ☆12Updated 3 years ago
• X1nyuLu / PACE
  Patch-based Convlutional Encoder for vibrational spectrum recognition
  ☆13Updated last year
• pattilab / PeakDetective
  ☆11Updated last year
• eMetaboHUB / FragHub
  ☆14Updated last week
• Elizachem / SMRT_transfer
  ☆11Updated 3 years ago
• fmolivato / RamanDataGenerator
  Generator useful to handle Raman spectra data augmentation for deep learning models
  ☆27Updated 2 years ago
• michaelmarty / AnalChem
  Python notebooks for teaching analytical chemistry
  ☆13Updated 4 years ago
• paucablop / chemotools
  Integrate your chemometric tools with the scikit-learn API 🧪 🤖
  ☆63Updated last week
• zmzhang / pymass
  Package for analyzing MS with Python
  ☆10Updated 7 years ago
• sorenwacker / ms-peakonly
  Peak detection for untargeted metabolomics using Neural Network. High-level API based on peakonly by @Arseha.
  ☆17Updated last year
• Qiong-Yang / GNN-RT
  ☆15Updated 3 years ago
• usnistgov / dimspec
  The Database Infrastructure for Mass Spectrometry (DIMSpec) project
  ☆26Updated 3 months ago
• rpeckner-broad / Specter
  Specter: linear deconvolution for targeted analysis of data-independent acquisition mass spectrometry proteomics
  ☆17Updated 6 years ago
• hserf / DOSY_Net
  DOSY processing
  ☆10Updated 3 years ago
• Gscorreia89 / pyChemometrics
  pyChemometrics - Objects for multivariate analysis of chemometric and metabonomic datasets
  ☆41Updated 6 months ago