Supporting Information: Integrated Machine Learning, QSAR, SHAP, and Molecular Dynamics Pipeline for Peptide Activity Analysis
收藏DataCite Commons2026-04-07 更新2026-05-04 收录
下载链接:
https://data.mendeley.com/datasets/3yhgz8bdsv/1
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资源简介:
This repository contains the comprehensive computational workflow, source code, input datasets, and output results for the identification, evaluation, and modeling of active peptides. The analytical pipeline integrates multi-criteria decision-making (MCDM), Quantitative Structure-Activity Relationship (QSAR) machine learning modeling, SHAP-based interpretability, and Molecular Dynamics (MD) simulation trajectory analysis.
提供机构:
Mendeley Data
创建时间:
2026-04-07



