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Journal of Molecular Graphics & Modelling|June 4, 2016
Mechanisms of histone lysine-modifying enzymes: A computational perspective on the role of the protein environmentWilian Augusto Cortopassi, Kiran Kumar, Fernanda Duarte, et al.Journal of Molecular Graphics & Modelling|November 21, 2017
Molecular insights into inclusion complexes of mansonone E and H enantiomers with various β-cyclodextrinsPanupong Mahalapbutr, Bodee Nutho, Peter Wolschann, et al.Journal of Molecular Graphics & Modelling|November 21, 2017
Structure-based design of hERG-neutral antihypertensive oxazalone and imidazolone derivativesBusecan Aksoydan, Isik Kantarcioglu, Ismail Erol, et al.Journal of Molecular Graphics & Modelling|November 21, 2017
Structure-based methods to predict mutational resistance to diarylpyrimidine non-nucleoside reverse transcriptase inhibitorsSyeda Maryam Azeem, Alecia N Muwonge, Nehaben Thakkar, et al.Journal of Molecular Graphics & Modelling|September 5, 2017
BMP-2 and BMP-9 binding specificities with ALK-3 in aqueous solution with dynamicsOrkid Coskuner, Vladimir N UverskyJournal of Molecular Graphics & Modelling|September 5, 2017
Understanding molecular interactions between scavenger receptor A and its natural product inhibitors through molecular modeling studiesPiyusha P Pagare, Saheem A Zaidi, Xiaomei Zhang, et al.Journal of Molecular Graphics & Modelling|September 18, 2017
In silico interaction analysis of cannabinoid receptor interacting protein 1b (CRIP1b) - CB1 cannabinoid receptorPratishtha Singh, Anjali Ganjiwale, Allyn C Howlett, et al.Journal of Molecular Graphics & Modelling|September 14, 2017
Multiscale molecular dynamics simulations of lipid interactions with P-glycoprotein in a complex membraneLaura Domicevica, Heidi Koldsø, Philip C BigginJournal of Molecular Graphics & Modelling|June 26, 2016
QM/MM investigation of the reaction rates of substrates of 2,3-dimethylmalate lyase: A catabolic protein isolated from Aspergillus nigerWarot Chotpatiwetchkul, Nathjanan Jongkon, Supa Hannongbua, et al.Journal of Molecular Graphics & Modelling|July 9, 2016
Theoretical and experimental investigation on the capture of H2S in a series of ionic liquidsXinming Zhou, Bobo Cao, Shuangyue Liu, et al.Pageof 400