Concepedia

Discovery of 4-aminophenylacetamide derivatives as intestine-specific farnesoid X receptor antagonists for the potential treatment of nonalcoholic steatohepatitis

Cong Chen, Bing Zhang, Jiaojiao Tu, Yanfen Peng, Yihuan Zhou, Xinping Yang, Qi-Ming Yu, Xiangduan Tan

European Journal of Medicinal Chemistry · 2023 · 12 citations · 38 references

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AutoDock Vina: Improving the speed and accuracy of docking with a new scoring function, efficient optimization, and multithreading

Oleg Trott, Arthur J. Olson · Journal of Computational Chemistry · 2009 · 35.1K citations · Full text

AutoDock Vina 1.2.0: New Docking Methods, Expanded Force Field, and Python Bindings

Jérôme Eberhardt, Diogo Santos‐Martins, Andreas F. Tillack et al. · Journal of Chemical Information and Modeling · 2021 · 5.7K citations · Full text

Detailed analysis of grid‐based molecular docking: A case study of CDOCKER—A CHARMm‐based MD docking algorithm

Guosheng Wu, D. H. Robertson, Charles L. Brooks et al. · Journal of Computational Chemistry · 2003 · 1.5K citations

Gut microbiota and intestinal FXR mediate the clinical benefits of metformin

Lulu Sun, Cen Xie, Guang Wang et al. · Nature Medicine · 2018 · 961 citations · Full text

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An improved GROMOS96 force field for aliphatic hydrocarbons in the condensed phase

Lukas D. Schuler, Xavier Daura, Wilfred F. van Gunsteren · Journal of Computational Chemistry · 2001 · 886 citations

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