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Protein interactions

Edge-enhanced interaction graph network for protein-ligand binding affinity prediction

Dinghai Yang, Linai Kuang, An Hu

published 08 Apr 2025

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Kernel composition in sorghum landraces revealed via analyses of genotype-by-environment interactions

Chalachew Endalamaw, Dagmawit Tsegaye, Angeline van Biljon, Liezel Herselman, Maryke Labuschagne

published 07 Apr 2025

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The interaction of Orthoflavivirus nonstructural proteins 3 and 5 with human fatty acid synthase

Suthatta Sornprasert, Wannapa Sornjai, Duncan R. Smith

published 25 Mar 2025

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In silico identification of novel ligands targeting stress-related human FKBP5 protein in mental disorders

Ovinuchi Ejiohuo, Donald Bajia, Joanna Pawlak, Aleksandra Szczepankiewicz

published 17 Mar 2025

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Analysis of cellular senescence-related genes in calcified aortic valve disease and the potential therapeutic role of β-Carotene

Yijing Tao, Chengjie Gao, Juan Wang, Qiyin Zhang, Zhisong Wang, Leng Han, Donglai Cao, Qianwen Yao

published 10 Mar 2025

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In Vitro and In Silico Antidiabetic Efficacy of Solanum lasiocarpum Dunal Fruit Extract

Jing Zhao, Ahmed Abdulkareem Najm, Ibrahim Mahmood, Zhang Yu Ming, Partha Pratim Dutta, Wamidh H. Talib, Douglas Law, Shazrul Fazry

published 10 Mar 2025

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Trypanosomes lack a canonical EJC but possess an UPF1 dependent NMD-like pathway

Bernardo Papini Gabiatti, Eden Ribeiro Freire, Johanna Odenwald, Janaina de Freitas Nascimento, Fabiola Holetz, Mark Carrington, Susanne Kramer, Martin Zoltner

published 07 Mar 2025

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Identifying novel inhibitors against drug-resistant mutant CYP-51 Candida albicans: A computational study to combat fungal infections

Saadia Jabeen, Muhammad Umer Khan, Hasan Ejaz, Shakeel Waqar, Aisha Farhana, Muharib Alruwaili, Yasir Alruwaili, Abualgasim Elgaili Abdalla, Sahar Mudassar, Qurban Ali

published 04 Mar 2025

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Prediction of protein interactions with function in protein (de-)phosphorylation

Aimilia-Christina Vagiona, Sofia Notopoulou, Zbyněk Zdráhal, Mariane Gonçalves-Kulik, Spyros Petrakis, Miguel A. Andrade-Navarro

published 03 Mar 2025

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Molecular screening and dynamics simulation reveal potential phytocompounds in Swertia chirayita targeting the UspA1 protein of Moraxella catarrhalis for COPD therapy

Md. Moin Uddin, Md. Shydhur Rahman Chowdhury, Md. Arju Hossain, Asif Ahsan, Md. Tanvir Hossain, Abdul Barik, Md. Arif Hossen, Md. Faisal Amin, Rafsan Abir, Mohammad Shah Alam, Md Habibur Rahman, M. Nazmul Hoque

published 28 Feb 2025

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Exploring cotton plant compounds for novel treatments against brain-eating Naegleria fowleri: An In-silico approach

Aqal Zaman, Sana Noor, Iqra Ahmad, Muhammad Shehroz, Nour Alhajri, Sibtain Ahmed, Umar Nishan, Sheheryar Sheheryar, Riaz Ullah, Abdelaaty A. Shahat, Hanna Dib, Mohibullah Shah

published 24 Feb 2025

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Targeting beta-lactamase activity with Oxacyclohexadecan-2-one in carbapenem-resistant uropathogenic E. coli: A molecular simulation approach

Priyanka Balaji, Madhana Priya N, Emmanuel Bhaskar M., Gnanasambandan R, Solomon F. D. Paul, Magesh R.

published 18 Feb 2025

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Modelling protein-protein interactions for the design of vaccine chimeric antigens with protective epitopes

Marinela Contreras, Marta Rafael, Isidro Sobrino, Consuelo Almazán, Juan J. Pastor Comín, James J. Valdés, Carlos Roberto Prudencio, Daniel Ferreira de Lima Neto, Veniamin A. Borin, Pratul K. Agarwal, Paul D. Kasaija, Rubén Fernández-Melgar, Justus Rutaisire, José de la Fuente

published 10 Feb 2025

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