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Journal of Molecular Graphics & Modelling|April 23, 2017
Molecular dynamic simulations on TKX-50/RDX cocrystalShuling Xiong, Shusen Chen, Shaohua JinJournal of Molecular Graphics & Modelling|April 18, 2017
Design of the magnetic homonuclear bonds boron nitride nanosheets using DFT methodsE Chigo Anota, A Bautista Hernández, A Escobedo Morales, et al.Journal of Molecular Graphics & Modelling|April 16, 2017
Theoretical insights into the interaction between RunPt13-n (n=4, 7 and 9) clusters and [BMIM]+ based ionic liquids: Effect of anionPing Cheng, Yongpeng Yang, Shiping HuangJournal of Molecular Graphics & Modelling|October 26, 2018
3D-QSAR studies of D3R antagonists and 5-HT1AR agonistsJialing Ma, Hui Zhang, Xin Zhang, et al.Journal of Molecular Graphics & Modelling|October 11, 2016
In silico approaches and proportional odds model towards identifying selective ADAM17 inhibitors from anti-inflammatory natural moleculesPallab Kumar Borah, Sourav Chakraborty, Anupam N Jha, et al.Journal of Molecular Graphics & Modelling|October 11, 2016
Homology modeling of a Class A GPCR in the inactive conformation: A quantitative analysis of the correlation between model/template sequence identity and model accuracyStefano Costanzi, Matthew Skorski, Alessandro Deplano, et al.Journal of Molecular Graphics & Modelling|January 30, 2014
Discovery of potent inhibitor for matrix metalloproteinase-9 by pharmacophore based modeling and dynamics simulation studiesSukesh Kalva, E R Azhagiya Singam, V Rajapandian, et al.Journal of Molecular Graphics & Modelling|October 23, 1998
Prediction of properties of chiral compounds by molecular topologyJ V de Julián-Ortiz, C de Gregorio Alapont, I Ríos-Santamarina, et al.Journal of Molecular Graphics & Modelling|January 8, 1999
Characterizing cavities in model inclusion molecules: a comparative studyF Torrens, J Sánchez-Marín, I Nebot-GilJournal of Molecular Graphics & Modelling|January 8, 1999
Molecular modelling of Me(2+)-(8-hydroxy-quinolinate)2 complexes using ZINDO and ESSF methodsD V Nicolau, S YoshikawaPageof 401