Alternatives and similar repositories for LSTM_Chem

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

• BenevolentAI / MolBERT
  ☆138Updated 4 years ago
• insilicomedicine / BiAAE
  Molecular Generation for Desired Transcriptome Changes with Adversarial Autoencoders
  ☆53Updated 5 years ago
• benstaf / ChemGAN-challenge
  Code for the paper: ChemGAN challenge for drug discovery: can AI reproduce natural chemical diversity? arXiv preprint arXiv:1708.08227.
  ☆113Updated 2 years ago
• deepchem / torchchem
  An experimental repo for experimenting with PyTorch models
  ☆36Updated 2 years ago
• marcopodda / fragment-based-dgm
  Code for the paper "A Deep Generative Model for Fragment-Based Molecule Generation" (AISTATS 2020)
  ☆67Updated 2 years ago
• isayev / ReLeaSE
  Deep Reinforcement Learning for de-novo Drug Design
  ☆362Updated 3 years ago
• NVIDIA / cheminformatics
  Facilitates searching, screening, and organizing large chemical databases
  ☆168Updated last year
• pcko1 / Deep-Drug-Coder
  A tensorflow.keras generative neural network for de novo drug design, first-authored in Nature Machine Intelligence while working at Astr…
  ☆186Updated 2 years ago
• edvardlindelof / graph-neural-networks-for-drug-discovery
  ☆96Updated 5 years ago
• EBjerrum / SMILES-enumeration
  SMILES enumeration for QSAR modelling using LSTM recurrent neural networks
  ☆243Updated 3 years ago
• XuhanLiu / DrugEx
  Deep learning toolkit for Drug Design with Pareto-based Multi-Objective optimization in Polypharmacology
  ☆214Updated 2 years ago
• deepchem / moleculenet
  Moleculenet.ai Datasets And Splits
  ☆103Updated 4 years ago
• masashitsubaki / molecularGNN_3Dstructure
  Graph neural network (GNN) for molecular property prediction (3D structure)
  ☆99Updated 4 years ago
• cansyl / DEEPScreen
  DEEPScreen: Virtual Screening with Deep Convolutional Neural Networks Using Compound Images
  ☆113Updated last year
• mattragoza / LiGAN
  Deep generative models of 3D grids for structure-based drug discovery
  ☆231Updated 2 years ago
• schrodinger / schrodingerdeepchem
  Deep-learning models for Drug Discovery and Quantum Chemistry
  ☆27Updated 8 years ago
• gadsbyfly / PyBioMed
  machine learning, molecular descriptor
  ☆117Updated 2 years ago
• pulimeng / DeepDrug3D
  A convolutional neural network for classifying binding pockets based on spatial and chemical information extracted from the pockets.
  ☆103Updated 4 years ago
• BioSystemsUM / DeepMol
  DeepMol: A Machine and Deep Learning Framework for Computational Chemistry
  ☆158Updated last month
• shenwanxiang / ChemBench
  MoleculeNet benchmark dataset & MolMapNet dataset
  ☆63Updated 3 years ago
• LucaAngioloni / ProteinSecondaryStructure-CNN
  Protein Secondary Structure predictor using Convolutional Neural Networks
  ☆113Updated 2 years ago
• BenevolentAI / guacamol_baselines
  Baselines models for GuacaMol benchmarks
  ☆141Updated last year
• Dierme / latent-gan
  An implementation of the Latent Gan as discribed in the publication [cite]
  ☆63Updated 4 years ago
• undeadpixel / reinvent-scaffold-decorator
  A SMILES-based encoder-decoder architecture for molecular scaffold decoration
  ☆81Updated 5 years ago
• GLambard / Molecules_Dataset_Collection
  Collection of data sets of molecules for a validation of properties inference
  ☆108Updated 7 years ago
• jonathanking / protein-transformer
  Predicting protein structure through sequence modeling
  ☆111Updated 5 years ago
• Acellera / moleculekit
  MoleculeKit: Your favorite molecule manipulation kit
  ☆226Updated last month
• bioinf-jku / FCD
  Fréchet ChemNet Distance: A quality measure for generative models for molecules
  ☆84Updated last year
• connorcoley / rexgen_direct
  Template-free prediction of organic reaction outcomes
  ☆154Updated 5 years ago
• kheyer / Retrosynthesis-Prediction
  Retrosynthesis reaction prediction using Transformer sequence to sequence models and SMILES based data augmentation
  ☆64Updated 5 years ago