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Journal of Molecular Graphics & Modelling|July 20, 2015
Evaluation of the aromaticity of non-planar and bowl-shaped molecules by NICS criterionAdel Reisi-Vanani, Ali Asghar RezaeiJournal of Molecular Graphics & Modelling|June 17, 2015
Qgui: A high-throughput interface for automated setup and analysis of free energy calculations and empirical valence bond simulations in biological systemsGeir Villy Isaksen, Tor Arne Heim Andberg, Johan Åqvist, et al.Journal of Molecular Graphics & Modelling|July 30, 2016
Overcoming the minimum image constraint using the closest point searchDavid M RogersJournal of Molecular Graphics & Modelling|July 31, 2016
Toluene promotes lid 2 interfacial activation of cold active solvent tolerant lipase from Pseudomonas fluorescens strain AMS8Norhayati Yaacob, Mohd Shukuri Mohamad Ali, Abu Bakar Salleh, et al.Journal of Molecular Graphics & Modelling|August 28, 2025
Exploring the interaction between a LRRK2/PP1CA interfering peptide and PP1CAJose Dominguez-Meijde, Samuel Murail, Rachid Boudjelloul, et al.Journal of Molecular Graphics & Modelling|August 22, 2021
Modeling protein structures with the coarse-grained UNRES force field in the CASP14 experimentAnna Antoniak, Iga Biskupek, Krzysztof K Bojarski, et al.Journal of Molecular Graphics & Modelling|August 2, 2021
Reproduction of macroscopic properties of unsaturated triacylglycerides using a modified NERD force fieldRobert J Cordina, Beccy Smith, Tell TuttleJournal of Molecular Graphics & Modelling|May 27, 2020
Designing a multi-epitope vaccine against blood-stage of Plasmodium falciparum by in silico approachesPeyman Bemani, Zahra Amirghofran, Mozafar MohammadiJournal of Molecular Graphics & Modelling|August 20, 2022
Molecular simulations of fluoxetine in hydrated lipid bilayers, as well as in aqueous solutions containing β-cyclodextrinGrigorios Megariotis, Georgios Mikaelian, Aggelos Avramopoulos, et al.Journal of Molecular Graphics & Modelling|May 15, 2021
Rational design, chemical synthesis and cellular evaluation of novel 1,3-diynyl derivatives of noscapine as potent tubulin binding anticancer agentsAmiya Kumar Patel, Rajesh Kumar Meher, Praveen Kumar Reddy, et al.Pageof 401