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Yeganeh Entezari Heravi, Hassan Sereshti, Ali Akbar Saboury, Jahan Ghasemi, Marzieh Amirmostofian & Claudiu T. Supuran. (2017) 3D QSAR studies, pharmacophore modeling, and virtual screening of diarylpyrazole–benzenesulfonamide derivatives as a template to obtain new inhibitors, using human carbonic anhydrase II as a model protein. Journal of Enzyme Inhibition and Medicinal Chemistry 32:1, pages 688-700.
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Eleni Vrontaki, Georgia Melagraki, Thomas Mavromoustakos & Antreas Afantitis. (2016) Searching for anthranilic acid-based thumb pocket 2 HCV NS5B polymerase inhibitors through a combination of molecular docking, 3D-QSAR and virtual screening. Journal of Enzyme Inhibition and Medicinal Chemistry 31:1, pages 38-52.
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Sachini P. Kadaoluwa Pathirannahalage, Nastaran Meftahi, Aaron Elbourne, Alessia C. G. Weiss, Chris F. McConville, Agilio Padua, David A. Winkler, Margarida Costa Gomes, Tamar L. Greaves, Tu C. Le, Quinn A. Besford & Andrew J. Christofferson. (2021) Systematic Comparison of the Structural and Dynamic Properties of Commonly Used Water Models for Molecular Dynamics Simulations. Journal of Chemical Information and Modeling 61:9, pages 4521-4536.
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Razieh Sheikhpour, Sajjad Gharaghani & Elmira Nazarshodeh. (2020) Sparse feature selection in multi-target modeling of carbonic anhydrase isoforms by exploiting shared information among multiple targets. Chemometrics and Intelligent Laboratory Systems 200, pages 104000.
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Weineng Zhou, Shuai Lu, Yanmin Zhang, Lingfeng Yin, Lu Zhu, Junnan Zhao, Tao Lu, Yadong Chen & Haichun Liu. (2019) In Silico Design of New B-Raf Kinase Type-II Inhibitors Through Combined Molecular Modeling Studies. Letters in Drug Design & Discovery 16:5, pages 570-583.
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Behnam Rasti, Mohsen Namazi, M. H. Karimi-Jafari & Jahan B. Ghasemi. (2017) Proteochemometric Modeling of the Interaction Space of Carbonic Anhydrase and its Inhibitors: An Assessment of Structure-based and Sequence-based Descriptors. Molecular Informatics 36:4, pages 1600102.
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Behnam Rasti, Mohammad H. Karimi-Jafari & Jahan B. Ghasemi. (2016) Quantitative Characterization of the Interaction Space of the Mammalian Carbonic Anhydrase Isoforms I, II, VII, IX, XII, and XIV and their Inhibitors, Using the Proteochemometric Approach. Chemical Biology & Drug Design 88:3, pages 341-353.
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Jahan B. Ghasemi, Elham Aghaee & Ali Jabbari. (2013) Docking, CoMFA and CoMSIA Studies of a Series of N-Benzoylated Phenoxazines and Phenothiazines Derivatives as Antiproliferative Agents. Bulletin of the Korean Chemical Society 34:3, pages 899-906.
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