Alternatives and similar repositories for GPT-MolBERTa

Users that are interested in GPT-MolBERTa are comparing it to the libraries listed below

• LBBSoft / DeepCDA
  DeepCDA
  ☆15Updated 5 years ago
• HUBioDataLab / ProtBENCH
  ☆12Updated last year
• 5AGE-zhang / TocoDecoy
  ☆11Updated 3 years ago
• keiserlab / autofragdiff
  Autoregressive fragment-based diffusion for target-aware ligand design
  ☆32Updated last year
• conghaowang / GLDM
  ☆20Updated last year
• idrugLab / ADCNet
  ☆26Updated 8 months ago
• schwallergroup / mhnn
  Molecular Hypergraph Neural Network
  ☆43Updated 6 months ago
• snu-lcbc / atom-in-SMILES
  Atom-in-SMILES tokenizer for SMILES strings.
  ☆42Updated last year
• idrugLab / hignn
  Code for "HiGNN: A Hierarchical Informative Graph Neural Network for Molecular Property Prediction Equipped with Feature-Wise Attention"
  ☆53Updated 3 years ago
• uta-smile / SMILES-BERT
  ☆52Updated 5 years ago
• aivant / ShapeLinker
  ☆25Updated last month
• rxn4chemistry / disconnection_aware_retrosynthesis
  ☆31Updated 3 years ago
• LumosBio / MolData
  A Molecular Benchmark for Disease and Target Based Machine Learning
  ☆24Updated 3 years ago
• uta-smile / CD-MVGNN
  ☆14Updated 4 years ago
• admislf / MINN-DTI
  Effective drug-target interaction prediction with mutual interaction neural network
  ☆33Updated 3 years ago
• pgniewko / solubility
  My (small) research project in solubility of drug-like molecules
  ☆18Updated 5 years ago
• CQ-zhang-2016 / Rag2Mol
  Structure-based drug design based on Retrieval Augmented Generation
  ☆24Updated 2 months ago
• larngroup / DTITR
  DTITR: End-to-End Drug-Target Binding Affinity Prediction with Transformers
  ☆15Updated 2 years ago
• mathcom / COMA
  COMA: Efficient Structure-constrained Molecular Generation using Contractive and Margin losses
  ☆18Updated 2 years ago
• danielvlla / Few-Shot-Learning-for-Low-Data-Drug-Discovery
  Few-shot machine learning for low-data drug discovery.
  ☆19Updated 3 years ago
• ziqi92 / Modof
  Molecule Optimization via Fragment-based Generative Models
  ☆43Updated 2 years ago
• smiles724 / MROT
  ☆12Updated 7 months ago
• LabWeng / MeTDDI
  ☆29Updated last year
• PaccMann / chemical_representation_learning_for_toxicity_prediction
  Chemical representation learning paper in Digital Discovery
  ☆63Updated last year
• YinanHuang / 3DLinker
  An E(3) Equivariant Variational Autoencoder for Molecular Linker Design
  ☆51Updated 3 years ago
• BFeng14 / ActFound
  Official implementation for ActFound (Nature Machine Intelligence): A bioactivity foundation model using pairwise meta-learning
  ☆45Updated last year
• MolecularAI / MolBART
  Pretrained SMILES transformation model for finetuning for diverse molecular tasks.
  ☆54Updated 3 years ago
• bayeslabs / genmol
  Molecular Structure Generation
  ☆34Updated last year
• maxime-langevin / scaffold-constrained-generation
  ☆41Updated 5 years ago
• Genentech / ringer
  RINGER: Rapid Conformer Generation for Macrocycles with Sequence-Conditioned Internal Coordinate Diffusion
  ☆21Updated last year