Alternatives and similar repositories for CrySTINet

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

• X1nyuLu / PACE
  Patch-based Convlutional Encoder for vibrational spectrum recognition
  ☆12Updated 9 months ago
• deepmaterials / dlmatreview
  Repository for links to software packages and databases used in deep-learning applications for materials science
  ☆142Updated 2 months ago
• Open-Catalyst-Project / AdsorbML
  Corresponding dataset and tools for the AdsorbML manuscript.
  ☆40Updated 5 months ago
• jrlLAB / hardpotato
  Python API to control programmable potentiostats
  ☆31Updated 6 months ago
• MSM-RAD-X-VMD-Plugin / PACKMOL-GUI
  An Integrated VMD Graphical User Interface for Molecular Packing
  ☆22Updated 6 months ago
• JorenBE / GPT-Challenge
  ☆12Updated 8 months ago
• ClarkResearchGroup / stem-learning
  Package to use an FCN to learn defects from STEM imaging
  ☆24Updated 2 years ago
• ppdebreuck / modnet
  MODNet: a framework for machine learning materials properties
  ☆93Updated 2 months ago
• schnarc / SchNarc
  ☆25Updated 2 years ago
• lmj1029123 / SingleNN
  SingleNN, a NN potential for energy and forces
  ☆9Updated 3 years ago
• StefanoSanvitoGroup / BERT-PSIE-TC
  A dataset of Curie temperatures automatically extracted from scientific literature with the use of the BERT-PSIE pipeline
  ☆15Updated last year
• Ohio-State-Allen-Lab / FTIRMachineLearning
  ☆37Updated 3 years ago
• XMUSpecLab / Noise-learning
  Noise learning for Raman microscopy
  ☆12Updated last year
• materialsproject / matbench
  Matbench: Benchmarks for materials science property prediction
  ☆160Updated 10 months ago
• orlandoacevedo / GAML
  Genetic Algorithm Machine Learning (GAML) software package for automated force field parameterization.
  ☆15Updated 4 years ago
• rxn4chemistry / nmr-to-structure
  Prediction molecular structure from NMR spectra
  ☆34Updated last year
• tsudalab / FL_ChemTS
  molecule design for fluorescence
  ☆12Updated 3 years ago
• sbanik2 / CEGANN
  Crystal Edge Graph Attention Neural Network
  ☆22Updated last year
• XiaqiongFan / DeepRaman
  A Universal and Accurate Method for Easily Component identification in Raman Spectroscopy Based on Deep Learning
  ☆31Updated 9 months ago
• Frank-LIU-520 / DeepMoleNet
  Deep learning for molecules quantum chemistry properties prediction
  ☆41Updated 4 years ago
• usnistgov / chemnlp
  ChemNLP: A Natural Language Processing based Library for Materials Chemistry Text Data
  ☆76Updated 3 weeks ago
• rxn4chemistry / rxn-ir-to-structure
  Predicting molecular structure from Infrared (IR) Spectra
  ☆22Updated last year
• molmd / mispr
  A software for automating materials science computations
  ☆31Updated last month
• materialsproject / reaction-network
  Reaction Network is a Python package for predicting likely inorganic chemical reaction pathways using graph theoretical methods. Project …
  ☆112Updated 5 months ago
• rxn4chemistry / rxn-reaction-preprocessing
  Preprocessing of datasets of chemical reactions: standardization, filtering, augmentation, tokenization, etc.
  ☆13Updated last year
• egtai / MD_LJP
  An elementary MD simulation program written in python
  ☆24Updated 3 years ago
• mattmcdermott / novel-materials-screening
  Screening the Materials Project for novel materials to be synthesized by the autonomous laboratory (A-Lab).
  ☆44Updated last year
• anthony-wang / CrabNet
  Predict materials properties using only the composition information!
  ☆106Updated 2 years ago
• mjwen / bondnet
  A graph neural network for the prediction of bond dissociation energies for molecules of any charge.
  ☆63Updated 2 years ago
• muammar / ml4chem
  ML4Chem: Machine Learning for Chemistry and Materials
  ☆98Updated 7 months ago