खोज परिणाम - "molecular dynamics"

Homodimerization of CB2 cannabinoid receptor triggered by a bivalent ligand enhances cellular signaling द्वारा Gemma Navarro, Marc Gómez-Autet, Paula Morales, Joan Biel Rebassa, Claudia Llinas del Torrent, Nadine Jagerovic, Leonardo Pardo, Rafael Franco

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Identification of potential extracellular signal-regulated protein kinase 2 inhibitors based on multiple virtual screening strategies द्वारा Ruoqi Yang, Ruoqi Yang, Guiping Zhao, Lili Zhang, Yu Xia, Huijuan Yu, Bin Yan, Bin Cheng, Bin Cheng

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Screening of phytoconstituents of Andrographis paniculata against various targets of Japanese encephalitis virus: An in-silico and in-vitro target-based approach द्वारा Shailesh Bhosale, Anoop Kumar

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Watermelon: setup and validation of an in silico fragment-based approach द्वारा Miriana Di Stefano, Salvatore Galati, Lisa Piazza, Francesca Gado, Carlotta Granchi, Marco Macchia, Antonio Giordano, Tiziano Tuccinardi, Giulio Poli

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Synthesis, characterization, antimicrobial activity, and in silico assessment of a novel pyrazoline carboxamide heterocyclic compound द्वारा Farouk Boudou, Abdelghani Sehmi, Amal Belakredar, Oussama Zaoui

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Ionic co-aggregates (ICAs) based oral drug delivery: Solubilization and permeability improvement द्वारा Xianzi Zheng, Zhezheng Fang, Weizi Huang, Jianping Qi, Xiaochun Dong, Weili Zhao, Wei Wu, Yi Lu

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Deciphering deamidation and isomerization in therapeutic proteins: Effect of neighboring residue द्वारा Flaviyan Jerome Irudayanathan, Jonathan Zarzar, Jasper Lin, Saeed Izadi

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Computational Drug Design against Ebola Virus Targeting Viral Matrix Protein VP30 द्वारा Arthi Venkatesan, Lavanya Ravichandran, J Febin Prabhu Dass

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Studies on the Interaction between Model Proteins and Fluorinated Ionic Liquids द्वारा Márcia M. S. Alves, Manuel N. Melo, Haydyn D. T. Mertens, Ana B. Pereiro, Margarida Archer

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Inhibition of soluble epoxide hydrolase by phytochemical constituents of the root bark of Ulmus davidiana var. japonica द्वारा Jang Hoon Kim, Ji Su Park, Yun Ji Lee, Sena Choi, Young Ho Kim, Seo Young Yang

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The Histone Deacetylase Family: Structural Features and Application of Combined Computational Methods द्वारा Antonio Curcio, Roberta Rocca, Stefano Alcaro, Anna Artese

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Mind the Gap-Deciphering GPCR Pharmacology Using 3D Pharmacophores and Artificial Intelligence द्वारा Theresa Noonan, Katrin Denzinger, Valerij Talagayev, Yu Chen, Kristina Puls, Clemens Alexander Wolf, Sijie Liu, Trung Ngoc Nguyen, Gerhard Wolber

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Cryo-EM Structure and Activator Screening of Human Tryptophan Hydroxylase 2 द्वारा Kongfu Zhu, Chao Liu, Yuanzhu Gao, Jianping Lu, Daping Wang, Daping Wang, Huawei Zhang, Huawei Zhang

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Synthesis, characterization, antimicrobial activity, and in silico assessment of a novel pyrazoline carboxamide heterocyclic compound द्वारा Farouk Boudou, Abdelghani Sehmi, Amal Belakredar, Oussama Zaoui

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Fluorine and chlorine substituted adamantyl-urea as molecular tools for inhibition of human soluble epoxide hydrolase with picomolar efficacy द्वारा Vladimir V. Burmistrov, Christophe Morisseau, Dmitry V. Danilov, Boris P. Gladkikh, Vladimir S. D'yachenko, Nikolay A. Zefirov, Olga N. Zefirova, Gennady M. Butov, Bruce D. Hammock

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Evaluation of caffeine as inhibitor against collagenase, elastase and tyrosinase using in silico and in vitro approach द्वारा Kyung Eun Lee, Shiv Bharadwaj, Umesh Yadava, Sang Gu Kang

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Synthesis, characterization, antimicrobial activity, and in silico assessment of a novel pyrazoline carboxamide heterocyclic compound द्वारा Farouk Boudou, Abdelghani Sehmi, Amal Belakredar, Oussama Zaoui

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Synthesis and evaluation of anticancer activities of 2- or 4-substituted 3-(N-benzyltriazolylmethyl)-13α-oestrone derivatives द्वारा Rebeka Jójárt, Seyyed Ashkan Senobar Tahaei, Péter Trungel-Nagy, Zoltán Kele, Renáta Minorics, Gábor Paragi, István Zupkó, Erzsébet Mernyák

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In silico investigation of potential interleukin-8 (IL-8) and Cathelicidin (LL-37) inhibitors for rosacea treatment द्वारा Taufik Muhammad Fakih, Deis Hikmawati, Endang Sutedja, Reiva Farah Dwiyana, Nur Atik, Muchtaridi Muchtaridi

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Repositioning of Etravirine as a Potential CK1ε Inhibitor by Virtual Screening द्वारा Luis Córdova-Bahena, Axel A. Sánchez-Álvarez, Angel J. Ruiz-Moreno, Marco A. Velasco-Velázquez

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