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1
Unraveling the Structural Changes in the DNA-Binding Region of Tumor Protein p53 ( TP53 ) upon Hotspot Mutation p53 Arg248 by Comparative Computational Approach
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Article
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Unraveling the Structural Changes in the DNA-Binding Region of Tumor Protein p53 ( TP53 ) upon Hotspot Mutation p53 Arg248 by Comparative Computational Approach

Balasundaram, Ambritha ; Doss, C George Priya

International journal of molecular sciences, 2022-12, Vol.23 (24), p.15499 [Peer Reviewed Journal]

Switzerland: MDPI AG

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2
Enhancing Paraoxon Binding to Organophosphorus Hydrolase Active Site
Material Type:
Article
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Enhancing Paraoxon Binding to Organophosphorus Hydrolase Active Site

El Khoury, Léa ; Mobley, David L ; Ye, Dongmei ; Rempe, Susan B

International journal of molecular sciences, 2021-11, Vol.22 (23), p.12624 [Peer Reviewed Journal]

Switzerland: MDPI AG

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3
Binding Thermodynamics and Dissociation Kinetics Analysis Uncover the Key Structural Motifs of Phenoxyphenol Derivatives as the Direct InhA Inhibitors and the Hotspot Residues of InhA
Material Type:
Article
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Binding Thermodynamics and Dissociation Kinetics Analysis Uncover the Key Structural Motifs of Phenoxyphenol Derivatives as the Direct InhA Inhibitors and the Hotspot Residues of InhA

Zhang, Qianqian ; Han, Jianting ; Zhu, Yongchang ; Tan, Shuoyan ; Liu, Huanxiang

International journal of molecular sciences, 2022-09, Vol.23 (17), p.10102 [Peer Reviewed Journal]

Basel: MDPI AG

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4
Dynamics, a Powerful Component of Current and Future in Silico Approaches for Protein Design and Engineering
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Article
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Dynamics, a Powerful Component of Current and Future in Silico Approaches for Protein Design and Engineering

Surpeta, Bartłomiej ; Sequeiros-Borja, Carlos Eduardo ; Brezovsky, Jan

International journal of molecular sciences, 2020-04, Vol.21 (8), p.2713 [Peer Reviewed Journal]

Switzerland: MDPI AG

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