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Molecular Simulation Volume 43, 2017 - Issue 13-16: Proceedings of the 4th International Conference on Molecular Simulation
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Articles

Predicting the activity of hydroxamic acid analogues

Qingzhu JiaSchool of Marine and Environmental Science, Tianjin University of Science and Technology, Tianjin, P.R. China
,
Ying LiuSchool of Marine and Environmental Science, Tianjin University of Science and Technology, Tianjin, P.R. China
,
Fangyou YanSchool of Chemical Engineering and Material Science, Tianjin University of Science and Technology, Tianjin, P.R. China
,
Qiang WangSchool of Chemical Engineering and Material Science, Tianjin University of Science and Technology, Tianjin, P.R. ChinaCorrespondence[email protected]
&
Peisheng MaSchool of Chemical Engineering and Technology, Tianjin University, Tianjin, P.R. China
Pages 1026-1033 | Received 29 Dec 2016, Accepted 03 Jul 2017, Published online: 17 Jul 2017

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Ramachandren Dushanan, Samantha Weerasinghe, Dhammike P. Dissanayake & Rajendram Senthilinithy. (2022) Implication of Ab Initio, QM/MM, and molecular dynamics calculations on the prediction of the therapeutic potential of some selected HDAC inhibitors. Molecular Simulation 48:16, pages 1464-1475.
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Raj Kaushal & Mandeep Kaur. (2022) Antidiabetic Potential of Ruthenium(III) Hydroxamate Complexes: Spectrophotometric Investigations. Current Enzyme Inhibition 18:3, pages 200-210.
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Qingzhu Jia, Qiyu Shi, Fangyou Yan & Qiang Wang. (2020) Norm index-based QSPR model for describing the n-octanol/water partition coefficients of organics. Environmental Science and Pollution Research 27:13, pages 15454-15462.
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Qingzhu Jia, Ting Liu, Fangyou Yan & Qiang Wang. (2019) Norm Index–Based QSAR Model for Acute Toxicity of Pesticides Toward Rainbow Trout. Environmental Toxicology and Chemistry 39:2, pages 352-358.
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