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Brenda de Souza Ferrari, Camilo Henrique da Silva Lima & Magaly Girão Albuquerque. (2023) Development, validation and analysis of a human profurin 3D model using comparative modeling and molecular dynamics simulations. Journal of Biomolecular Structure and Dynamics 0:0, pages 1-19.
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Wei Xie, Ming Wang, Aijing Li & Si-Chuan Xu. (2017) Molecular dynamics simulation of d-Benzedrine transmitting through molecular channels within D3R. Journal of Biomolecular Structure and Dynamics 35:8, pages 1672-1684.
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Masomeh Mehrabi, Reza Khodarahmi & Mohsen Shahlaei. (2017) Critical effects on binding of epidermal growth factor produced by amino acid substitutions. Journal of Biomolecular Structure and Dynamics 35:5, pages 1085-1101.
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Ekin Kestevur Doğru, Gülce Güralp, Arzu Uyar & Nur Basak Surmeli. (2023) Rational design of thermophilic CYP119 for progesterone hydroxylation by in silico mutagenesis and docking screening. Journal of Molecular Graphics and Modelling 118, pages 108323.
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Guohua Zhu & Haizhou Wang. (2022) Empirical Study of Large-Scale HLA Simulation of Parallel Region-Matching Knowledge Recognition Algorithm Based on Region Matching. Computational Intelligence and Neuroscience 2022, pages 1-9.
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Sajad Moradi, Parisa Moradi, Mohabbat Ansari, Rasool Khosravi, Negin Farhadian, Nasim Batooie & Mohsen Shahlaei. (2021) Investigating the protective effects of carbohydrate coatings on the structure and dynamic of l‐asparaginase against heat stress; a molecular dynamic simulation. Informatics in Medicine Unlocked 25, pages 100689.
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Mastaneh Shokri, Sajad Moradi, Sabrieh Amini, Mohsen Shahlaei, Farzad Seidi & Shahab Saedi. (2021) A novel amino cellulose derivative using ATRP method: Preparation, characterization, and investigation of its antibacterial activity. Bioorganic Chemistry 106, pages 104355.
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Zsófia Borbála Rózsa, Lukács József Németh, Balázs Jójárt, Károly Nehéz, Béla Viskolcz & Milán Szőri. (2019) Molecular Dynamics and Metadynamics Insights of 1,4-Dioxane-Induced Structural Changes of Biomembrane Models. The Journal of Physical Chemistry B 123:37, pages 7869-7884.
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Sajad Moradi, Amin Nowroozi & Mohsen Shahlaei. (2019) Shedding light on the structural properties of lipid bilayers using molecular dynamics simulation: a review study. RSC Advances 9:8, pages 4644-4658.
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Sajad Moradi, Elnaz Hosseini, Mohadese Abdoli, Solmaz Khani & Mohsen Shahlaei. (2019) Comparative molecular dynamic simulation study on the use of chitosan for temperature stabilization of interferon αII. Carbohydrate Polymers 203, pages 52-59.
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Seyed Zachariah Moradi, Amin Nowroozi, Komail Sadrjavadi, Sajad Moradi, Kamran Mansouri, Leila Hosseinzadeh & Mohsen Shahlaei. (2018) Direct evidences for the groove binding of the Clomifene to double stranded DNA. International Journal of Biological Macromolecules 114, pages 40-53.
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James A. R. Dalton, Jean-Philippe Pin & Jesús Giraldo. (2017) Analysis of positive and negative allosteric modulation in metabotropic glutamate receptors 4 and 5 with a dual ligand. Scientific Reports 7:1.
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