نتائج البحث

Improved prediction of ligand-protein binding affinities by meta-modeling

• Authors : Lee, Ho-Joon; Emani, Prashant S.; Gerstein, Mark B.

Subjects: Computer Science - Machine Learning; Quantitative Biology - Quantitative Methods

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Quantitative Characterization of the Impact of Protein–Protein Interactions on Ligand–Protein Binding: A Multi-Chain Dynamics Perturbation Analysis Method.

• Authors : Li, Lu¹ (AUTHOR) ; Li, Hao¹ (AUTHOR); Su, Ting¹ (AUTHOR)

• Source: International Journal of Molecular Sciences. Sep2024, Vol. 25 Issue 17, p9172. 13p.

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Quantitative Characterization of the Impact of Protein–Protein Interactions on Ligand–Protein Binding: A Multi-Chain Dynamics Perturbation Analysis Method

• Authors : Lu Li; Hao Li; Ting Su

Subjects: protein–protein interaction; ligand-binding region; LPIs

• Source: International Journal of Molecular Sciences, Vol 25, Iss 17, p 9172 (2024)

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A GU-Net-Based Architecture Predicting Ligand–Protein-Binding Atoms

• Authors : Fatemeh Nazem; Fahimeh Ghasemi; Afshin Fassihi

Subjects: graph convolutional neural network; point cloud semantic segmentation; protein–ligand-binding sites

• Source: Journal of Medical Signals and Sensors, Vol 13, Iss 1, Pp 1-10 (2023)

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A GU-Net-based architecture predicting ligand–Protein-binding atoms.

• Authors : Nazem, Fatemeh¹ (AUTHOR); Ghasemi, Fahimeh² (AUTHOR); Fassihi, Afshin³ (AUTHOR)

• Source: Journal of Medical Signals & Sensors. Jan-Mar2023, Vol. 13 Issue 1, p1-10. 10p.

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Accurate absolute free energies for ligand-protein binding based on non-equilibrium approaches

• Authors : Gapsys, Vytautas; Yildirim, Ahmet; Aldeghi, Matteo

• Source: Communications Chemistry. 4

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Accurate absolute free energies for ligand–protein binding based on non-equilibrium approaches

• Authors : Vytautas Gapsys; Ahmet Yildirim; Matteo Aldeghi

Subjects: Chemistry; QD1-999

• Source: Communications Chemistry, Vol 4, Iss 1, Pp 1-13 (2021)

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Nanoscale Ion Emitters in Native Mass Spectrometry for Measuring Ligand-Protein Binding Affinities

Subjects: Clinic for Surgery; 610 Medicine & health; Journal Article

• Source: Nguyen, Giang T H; Tran, Thinh N; Podgorski, Matthew N; Bell, Stephen G; Supuran, Claudiu T; Donald, William A (2019). Nanoscale Ion Emitters in Native Mass Spectrometry for Measuring

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Accurate absolute free energies for ligand-protein binding based on non-equilibrium approaches

Subjects: Theoretical Chemistry; Teoretisk kemi; Article in journal

تفاصيل العنوان

Accurate absolute free energies for ligand-protein binding based on non-equilibrium approaches

Subjects: Theoretical Chemistry; Teoretisk kemi; Article in journal

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