Alternatives and similar repositories for fuse-drug

Users that are interested in fuse-drug are comparing it to the libraries listed below

• colab-db / colab-db.github.io
  Repository of Jupyter Notebooks on Colab, Binder and Huggingface for Bio, Chemistry and Physics
  ☆14Updated 2 years ago
• ml-jku / cloome
  ☆36Updated 11 months ago
• leojklarner / Q-SAVI
  Drug Discovery under Covariate Shift with Domain-Informed Prior Distributions over Functions
  ☆24Updated 2 years ago
• AstraZeneca / StarGazer
  StarGazer is a tool designed for rapidly assessing drug repositioning opportunities. It combines multi-source, multi-omics data with a no…
  ☆35Updated 2 years ago
• Accio / AMIDD
  Introduction to Applied Mathematics and Informatics in Drug Discovery (AMIDD)
  ☆32Updated last week
• adaptyvbio / egfr_competition_1
  This repo contains the results data for Round 1 of Adaptyv Bio’s EGFR Protein Design Competition.
  ☆34Updated 9 months ago
• TravisWheelerLab / drug-sniffer
  Sniffing out new drugs
  ☆23Updated 2 years ago
• srijitseal / DILI
  Enhancing Early Detection of Drug-Induced Liver Injury Through Predicted in vivo and in vitro Data Integration
  ☆15Updated last month
• prescient-design / ibex
  Antibody structure prediction
  ☆26Updated last week
• ram-compbio / CANDO
  Computational Analysis of Novel Drug Opportunities
  ☆39Updated 2 weeks ago
• BiomedSciAI / biomed-multi-view
  This repository contains the implementation of the Multi-view Molecular Embedding with Late Fusion (MMELON) architecture. MMELON combines…
  ☆39Updated 4 months ago
• asapdiscovery / asap-polaris-blind-challenge-examples
  ☆13Updated 3 months ago
• ETHmodlab / molgrad
  Coloring molecules with explainable artificial intelligence
  ☆16Updated 4 years ago
• LBLQMM / MACAW
  ☆14Updated 3 years ago
• KrishnaswamyLab / ImmunoStruct
  ImmunoStruct: a multimodal neural network framework for immunogenicity prediction from peptide-MHC sequence, structure, and biochemical p…
  ☆12Updated 4 months ago
• john-bradshaw / ml-in-bioinformatics-summer-school-2020
  Tutorial for "Advances in machine learning for molecules" (for Summer School for Machine Learning in Bioinformatics, https://cs.hse.ru/ss…
  ☆20Updated 5 years ago
• ersilia-os / zaira-chem
  Automated QSAR based on multiple small molecule descriptors
  ☆42Updated 10 months ago
• CDDLeiden / PCMol
  Multi-target de novo molecular generator conditioned on AlphaFold's latent protein embeddings.
  ☆66Updated 6 months ago
• swansonk14 / chemfunc
  Useful functions for working with small molecules
  ☆54Updated 3 weeks ago
• genedisco / genedisco
  GeneDisco is a benchmark suite for evaluating active learning algorithms for experimental design in drug discovery.
  ☆40Updated 2 years ago
• amp91 / PeptideModels
  Code for peptide ligand design with machine learning models.
  ☆28Updated 10 months ago
• NasimAbdollahi / NodeCoder
  NodeCoder is a general framework based on graph convolutional neural network for protein function prediction.
  ☆33Updated last year
• sdecesco / targetDB
  TargetDB is a tool to quickly querry multiple publicly available databases and provide an integrated view of the information available ab…
  ☆32Updated last year
• meyresearch / DL_protein_ligand_affinity
  From Proteins to Ligands: Decoding Deep Learning Methods for Binding Affinity Prediction
  ☆18Updated last year
• rxn4chemistry / rxnaamapper
  Reaction SMILES-AA mapping via language modelling
  ☆29Updated last year
• nichrun / e3_diffusion_for_molecules
  ☆10Updated 2 years ago
• rxn4chemistry / disconnection_aware_retrosynthesis
  ☆30Updated 2 years ago
• i-shah / ml-organ-tox
  Data-driven chemical-induced toxicity prediction by machine learning using chemical and bioactivity data
  ☆10Updated 8 years ago
• pluskal-lab / MassSpecGym
  MassSpecGym: A benchmark for the discovery and identification of molecules (NeurIPS 2024 Spotlight)
  ☆92Updated last month
• davkovacs / MTExplainer
  This is an updated version of the MolecularTransformer of Schwaller et. al.
  ☆13Updated 3 years ago