drugdesign

There are 1 repository under drugdesign topic.

• lifanchen-simm / transformerCPI2.0

  Sequence-to-drug concept adds a perspective on drug design. It can serve as an alternative method to SBDD, particularly for proteins that do not yet have high-quality 3D structures available.

  drugdesignsequence-based
  Language:Python 52

• SourangshuGhosh / coronavirus_cure_DeepLearning

  Using deep learning to generate novel molecules as candidates for binding with coronavirus protease

  artificial-intelligenceartificial-neural-networkscoronavirusdeeplearningdrugdesignmachinelearningrecurrent-neural-networks
  Language:Jupyter Notebook 5

• francescopatane96 / Bioactivity-prediction-with-ML

  Create a bioactivity prediction model using molecular descriptors (PADEL) and supervised machine learning (ML).

  bioinformaticsbiologybiotechnologychemistrychemoinformaticsdatasciencedeep-learningdiscoverydrugdrugdesigndrugdiscoverymachine-learningmachinelearningmachinelearning-pythonpharmacologypharmacyrandomforestregression
  Language:Jupyter Notebook 1

• hansiu / ddgrupa4

  drug design university project by group nr 4

  drugdesignuniversity-projectchimerapythonrbioinformaticsobabel
  0

• manonreau / webpage

  Manon Réau, Bonvin Lab, CSB, UU, CNAM, GBCM, NR-DBIND, CADD, drug design, chemoinformatics, Theranalpha, TNF, Nuclear Receptors, negative data, benchmark

  manonnr-dbindreaudrugdesigncaddchemoinformaticscnambonvinlabgbcmstructuralbiology
  Language:SCSS 0