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Journal of Molecular Graphics & Modelling|July 14, 2020
Investigating the regio-, stereo-, and enantio-selectivities of the 1,3-dipolar cycloaddition reaction of C-cyclopropyl-N-phenylnitrone derivatives and benzylidenecyclopropane derivatives: A DFT studyGeorge Baffour Pipim, Richard Tia, Evans AdeiJournal of Molecular Graphics & Modelling|July 14, 2020
Type and size effect of functional groups on the novel antifolate target recognition folate receptors α and β: Docking, molecular dynamics and MM/PBSA studyYue Jiang, Cuihong Wang, Meiling Zhang, et al.Journal of Molecular Graphics & Modelling|July 14, 2020
Proposed model of the Dictyostelium cAMP receptors bound to cAMPJack Calum Greenhalgh, Aneesh Chandran, Matthew Thomas Harper, et al.Journal of Molecular Graphics & Modelling|August 3, 2020
The interaction nature between hollow silica-based porous ionic liquids and CO2: A DFT studyJinrui Zhang, Naixia Lv, Yanhong Chao, et al.Journal of Molecular Graphics & Modelling|May 27, 2014
Design of novel camphane-based derivatives with antimycobacterial activityGeorgi Stavrakov, Violeta Valcheva, Irena Philipova, et al.Journal of Molecular Graphics & Modelling|June 18, 2014
Investigating the binding preferences of small molecule inhibitors of human protein arginine methyltransferase 1 using molecular modellingWei Hong, Jingyang Li, Charles A Laughton, et al.Journal of Molecular Graphics & Modelling|April 2, 2015
Revised force-field parameters for chlorophyll-a, pheophytin-a and plastoquinone-9Federico Guerra, Suliman Adam, Ana-Nicoleta BondarJournal of Molecular Graphics & Modelling|July 4, 2020
Total non-lewis structures: An application to predict the stability and reactivity of linear and angular polyacenesMohammad Manassir, Ali H PakiariJournal of Molecular Graphics & Modelling|July 4, 2020
Molecular dynamics study of tensile behaviour for cold and linear friction welded single crystal tungstenRohit Singh, Varun SharmaJournal of Molecular Graphics & Modelling|January 27, 2015
Theoretical studies on the deacylation step of acylated Candida Antarctica lipase B: structural and reaction pathway analysisMohammad Sadegh Sadeghi Googheri, Mohammad Reza Housaindokht, Hassan SabzyanPageof 401