Alternatives and similar repositories for Optical-Chemical-Structure-Recognition

Users that are interested in Optical-Chemical-Structure-Recognition are comparing it to the libraries listed below

• arhamshah / SolubilityPrediction
  A web based application predicts water solubility of any given chemical compound known or unknown
  ☆11Updated 3 years ago
• hesther / templatecorr
  Hierarchical template correction for chemical reactions
  ☆14Updated 10 months ago
• nadinulrich / log_P_prediction
  ☆12Updated 4 years ago
• patonlab / BDE-db2
  GNN models and Datasets for Halogen BDEs
  ☆9Updated last year
• coleygroup / QM-augmented_GNN
  ☆19Updated 2 years ago
• mjwen / rxnrep
  Contrastive pretraining to learn chemical reaction representations (RxnRep) for downstream tasks.
  ☆33Updated 2 years ago
• simonmb / fragmentation_algorithm_paper
  Two algorithms to fragment molecules into specified molecular subunits (e.g. functional groups)
  ☆35Updated 3 years ago
• rxn4chemistry / OpenNMT-py
  RXN fork of OpenNMT-py - Open Source Neural Machine Translation in PyTorch
  ☆26Updated last year
• aspuru-guzik-group / da_for_polymers
  Augmenting Polymer Datasets via Iterative Rearrangement
  ☆11Updated last year
• NREL / polyID
  ☆15Updated last month
• theochem / gopt
  Python library for optimizing molecular structures and determining chemical reaction pathways.
  ☆17Updated last year
• dkoes / MD2NMR
  NMR Chemical Shifts from Molecular Dynamics Simulation
  ☆13Updated 3 years ago
• ASKCOS / askcos-data
  Data and model repository for the ASKCOS application
  ☆16Updated 3 years ago
• Masker-Li / ChemSelML
  A trivial demo of chemical regioselectivity prediction via machine learning
  ☆12Updated last year
• cgrambow / AutomaticReactionDiscovery
  Using quantum chemical computation to find important reactions without requiring human intuition.
  ☆18Updated 7 years ago
• duaibeom-zz / MolFinder
  ☆17Updated 4 years ago
• lukasturcani / atomlite
  Store your chemical data in a single file!
  ☆12Updated last month
• lucianlschan / Conformer-Geometry
  ☆12Updated 6 years ago
• zinph / ChemX
  Chemical Database Expander. For a given target compound, it generates a virtual chemical bank of analogues by replacing the substructures…
  ☆13Updated last year
• denoptim-project / DENOPTIM
  DENOPTIM is a software package for de novo design and virtual screening of functional molecules of any kind.
  ☆37Updated last month
• aspuru-guzik-group / assessing_mol_prediction_confidence
  https://arxiv.org/abs/2102.11439
  ☆20Updated 4 years ago
• whitead / synspace
  Synthesis generative model
  ☆45Updated 2 months ago
• MSM-RAD-X-VMD-Plugin / PACKMOL-GUI
  An Integrated VMD Graphical User Interface for Molecular Packing
  ☆22Updated 5 months ago
• alejandrosantanabonilla / pysoftk
  Python program for modelling and simulating polymers.
  ☆36Updated 3 weeks ago
• QChASM / SEQCROW
  Plug-in for ChimeraX providing features for building and manipulating organic and organometallic molecules as well as displaying output f…
  ☆28Updated last month
• ifyoungnet / ChemDes
  An integrated web-based platform for molecular descriptor and fingerprint computation
  ☆12Updated 8 years ago
• PEJpOhno / SMiPoly
  rule-based virtual polymer library generator
  ☆38Updated last week
• duartegroup / molfunc
  fast functionalisation of molecules
  ☆36Updated 3 years ago
• olsenlabmit / BigSMILES
  An open-source effort towards accessible polymer data
  ☆35Updated 4 years ago
• edbeard / pyosra
  Python wrapper for OSRA. Supports R-Group logic and integration with ChemSchematicResolver
  ☆10Updated 5 years ago