Binding Energy and Free Energy of Calcium Ion to Calmodulin EF-Hands with the Drude Polarizable Force Field-Reference-Cited by-同舟云学术

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Binding Energy and Free Energy of Calcium Ion to Calmodulin EF-Hands with the Drude Polarizable Force Field

Published:2021-12-28 Issue: Volume: Page:
ISSN:2694-2445
Container-title:ACS Physical Chemistry Au
language:en
Short-container-title:ACS Phys. Chem Au

Author:

Tan Qiaozhu¹²³,Ding Ye¹²³,Qiu Zongyang²³⁴,Huang Jing²³⁴^ORCID

Affiliation:

1. College of Life Sciences, Zhejiang University, Hangzhou 310058, Zhejiang, China

2. Key Laboratory of Structural Biology of Zhejiang Province, School of Life Sciences, Westlake University, Hangzhou 310024, Zhejiang, China

3. Westlake AI Therapeutics Lab, Westlake Laboratory of Life Sciences and Biomedicine, Hangzhou 310024, Zhejiang, China

4. Institute of Biology, Westlake Institute for Advanced Study, Hangzhou 310024, Zhejiang, China

Funder

China Postdoctoral Science Foundation

National Natural Science Foundation of China

Natural Science Foundation of Zhejiang Province

Publisher

American Chemical Society (ACS)

Link

https://pubs.acs.org/doi/pdf/10.1021/acsphyschemau.1c00039

Reference74 articles.

1. The machineries, regulation and cellular functions of mitochondrial calcium

2. Calcium Signaling

3. Calcium, calmodulin and cell cycle regulation

4. Calcium/calmodulin-dependent and -independent phytochrome signal transduction pathways

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3. Developing and Benchmarking Sulfate and Sulfamate Force Field Parameters for Glycosaminoglycans via Ab Initio Molecular Dynamics Simulations;2024-06-03

4. Energetic and structural insights behind calcium induced conformational transition in calmodulin;Proteins: Structure, Function, and Bioinformatics;2023-11

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