DFT, Molecular Docking, Molecular Dynamics Simulation, MMGBSA Calculation and Hirshfeld Surface Analysis of 5-Sulfosalicylic Acid
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Title
DFT, Molecular Docking, Molecular Dynamics Simulation, MMGBSA Calculation and Hirshfeld Surface Analysis of 5-Sulfosalicylic Acid
Authors
Keywords
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Journal
JOURNAL OF MOLECULAR STRUCTURE
Volume 1273, Issue -, Pages 134242
Publisher
Elsevier BV
Online
2022-10-01
DOI
10.1016/j.molstruc.2022.134242
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