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edlmppi's Introduction

EDLMPPI: Learning the Protein Language of Proteome-wide Protein-protein Binding Sites via Ensemble Deep Learning in an Interpretation Manner

EDLMPPI

Environment

conda install python==3.8.12
pip install tensorflow==2.4.1
pip install keras==2.4.3
pip install numpy==1.19.5

Usages

Extract MBF

  • Install dependencies
create a program directory
mkdir -p ../programs && cd ../program
git clone https://github.com/lucian-ilie/SPRINT.git
git checkout DELPHI_Server
make compute_HSPs_parallel
  • Install psiblast: 2.6.0+ and download the corresponding nr database. (The database used in EDLMPPI is Uniref90)
For Ubuntu:
sudo apt-get install ncbi-blast+
  • Intall hh-suite. The database used in DELPHI is uniprot20_2015_06.

  • Install GENN+ASAquick

  • Install ANCHOR

  • Run the following code to extract MBF

    bash feature_computation/compute_features.sh $INPUT_FN
    

Extract ProtT5

  • Install virtual environment

    conda create -n ProtT5 pyhton=3.7
    conda activate ProtT5
    
  • Following the steps showing in the ProtT5-XL-UniRef50.ipynb

  • Notes:

    The result will be saved as .npy

Train Example

  • Install virtual environment

    conda create -n PPI 
    conda activate PPI
    conda install python==3.8.12
    pip install tensorflow==2.4.1
    pip install keras==2.4.3
    pip install numpy==1.19.5
    
  • Download the Train Data at http://www.edlmppi.top:5002/download_train

  • Following the steps showing in the /train/run.ipynb

Predict Example

  • Install virtual environment

    conda create -n PPI 
    conda activate PPI
    conda install python==3.8.12
    pip install tensorflow==2.4.1
    pip install keras==2.4.3
    pip install numpy==1.19.5
    
  • The Predict Example can be download in current repository

    python ./predict/pred.py
    

Predict Online

Contact

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