通过分子对接、动力学模拟和MM/PBSA对天然SIRT1抑制剂进行计算机模拟鉴定 - Suppr

In Silico Identification of Natural SIRT1 Inhibitors through Molecular Docking, Dynamics Simulation, and MM/PBSA.

作者信息

Kardam Shefali, Kumar Pravir

机构信息

Molecular Neuroscience and Functional Genomics Laboratory, Department of Biotechnology, Delhi Technological University (Formerly DCE), Delhi, India.

出版信息

Cell Biochem Biophys. 2025 Sep 8. doi: 10.1007/s12013-025-01886-0.

DOI:10.1007/s12013-025-01886-0

PMID:40924381

Abstract

摘要

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In Silico Identification of Natural SIRT1 Inhibitors through Molecular Docking, Dynamics Simulation, and MM/PBSA.

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