pLMSNOSite

Webserver

You can access the webserver of pLMSNOSite at kcdukkalab.org/pLMSNOSite/.

Cite this article

Pratyush, P., Pokharel, S., Saigo, H. et al. pLMSNOSite: an ensemble-based approach for predicting protein S-nitrosylation sites by integrating supervised word embedding and embedding from pre-trained protein language model. BMC Bioinformatics 24, 41 (2023). https://doi.org/10.1186/s12859-023-05164-9

The corresponding BibTeX:

@article{ WOS:000934967300003,
Author = {Pratyush, Pawel and Pokharel, Suresh and Saigo, Hiroto and Kc, Dukka B.},
Title = {pLMSNOSite: an ensemble-based approach for predicting protein
   S-nitrosylation sites by integrating supervised word embedding and
   embedding from pre-trained protein language model},
Journal = {BMC BIOINFORMATICS},
Year = {2023},
Volume = {24},
Number = {1},
Month = {FEB 8},
DOI = {10.1186/s12859-023-05164-9},
Article-Number = {41},
ISSN = {1471-2105},
ORCID-Numbers = {Pratyush, Pawel/0000-0002-4210-1200},
Unique-ID = {WOS:000934967300003},
}

Authors

Pawel Pratyush¹, Suresh Pokharel¹, Hiroto Saigo², Dukka B KC^1*
1Department of Computer Science, Michigan Technological University, Houghton, MI, USA.
²Department of Electrical Engineering and Computer Science, Kyushu University, 744, Motooka, Nishi-ku, 819-0395, Japan

^* Corresponding Author: dbkc@mtu.edu

Getting Started 🚀

To get a local copy of the repository, you can either clone it or download it directly from GitHub.

Clone the Repository

If you have Git installed on your system, you can clone the repository by running the following command in your terminal:

git clone git@github.com:KCLabMTU/pLMSNOSite.git

Download the Repository

Alternatively, if you don't have Git or prefer not to use it, you can download the repository directly from GitHub. Click here to download the repository as a zip file.

Note: In the 'Download the Repository' section, the link provided is a direct download link to the repository's main branch as a zip file. This may differ if your repository's default branch is named differently.

Install Libraries

Python version: 3.9.7

To install the required libraries, run the following command:

pip install -r requirements.txt

Required libraries and versions: Bio==1.5.2 keras==2.9.0 matplotlib==3.5.1 numpy==1.23.5 pandas==1.5.0 requests==2.27.1 scikit_learn==1.2.0 seaborn==0.11.2 tensorflow==2.9.1 torch==1.11.0 tqdm==4.63.0 transformers==4.18.0 xgboost==1.5.0

Evaluate pLMSNOSite on Independent Test Set

To evaluate our model on the independent test set, we have already placed the test sequences and corresponding ProtT5 features in data/test/ folder. After installing all the requirements, run the following command:

 python evaluate_model.py

Predict S-Nitrosylation modification in your own sequence

1. Place your FASTA file in the input/sequence.fasta directory.
2. Run the following command:

   python predict.py

3. Find the results at output/ folder.

Training and other experiments

1. Find training data at data/train/ folder
2. Find all the codes and models related to training at training_experiments folder (To be updated).

Contact 📫

Should you have any inquiries related to this project, please feel free to reach out via email. Kindly CC all of the following recipients in your communication for a swift response:

• Main Contact: dbkc@mtu.edu
• CC: ppratyush@mtu.edu
• CC: sureshp@mtu.edu

We look forward to addressing your queries and concerns.