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Crystal structure

Identification of novel peripherally restricted risperidone-like dopamine D2 receptor antagonists for prolactin-mediated neuroprotection through a multi-stage in silico screening

Shinhyun Kim, Won Hee Jo, Jae Ok Cha, Min-Sun Kim

Assessment of generative de novo peptide design methods for G protein-coupled receptors

Hannes Junker, Clara T. Schoeder

Structural insights into the mosaic and modular organization of fourteen co-occurring resistance genes in multidrug resistant Enterobacteriaceae

Connor A. J. Rossel, Lieke B. van Alphen, Edou R. Heddema, Paul H. M. Savelkoul

Etching characteristics and profile simulation of silicon

Hui Zhang, Pengpeng Cai

Hetero-deformation induced stress and its microstructural morphology dependence in a near-alpha titanium alloy

Lin Xie, Jialian Li, Yuan Xing, Yuhui Wang

Molecular dynamics simulation study on macroscopic mechanical deterioration and microscopic hydration mechanism of mudstone

Lidong Hou, Shaojie Li, [ ... ], Ziyang Zhu

Enhancing the solubility of puerarin via melt sonocrystallization

Yaxiang Gong, Jiafu Wen, Wenqi Liu

Crystal structure of a closed ternary complex of a HNA Reverse Transcriptase in complex with a HNA/DNA duplex

Cédric Gutfreund, Mikhail Abramov, [ ... ], Andreas Marx

Extraction and characterization of microcrystalline cellulose from kelp (Laminaria japonica) waste

Zhenhua Liu, Wei Xie, Lan Ye, Chaojie Chen

Prediction of pre- and postfusion conformations of class I fusion proteins with AlphaFold2

Sevilay Gülesen, Victoria Most, Clara T. Schoeder, Jens Meiler

Predicting unknown binding sites for transition-metal-based compounds in proteins

Andrea Levy, Ursula Rothlisberger

Comprehensive reconstruction of the musculoskeletal anatomy in the shoulder using a hybrid 3D ultrasound mosaicking workflow: A pilot study

Ahmed Sewify, Marian Steffens, [ ... ], Davide Fontanarosa

Bisphenol BPAF and BPC are agonists for estrogen receptor ERα but antagonists for N-terminal domain-lacking ERα

Xiaohui Liu, Miki Shimohigashi, Yasuyuki Shimohigashi

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