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Journal of Molecular Graphics & Modelling|January 1, 2026
Integrated DFT and Monte Carlo study of the multifunctional properties of Ti2MnCo Heusler alloyZ Fadil, A Jabar, M Naziruddin Khan, et al.Journal of Molecular Graphics & Modelling|February 23, 2002
Consensus scoring for ligand/protein interactionsRobert D Clark, Alexander Strizhev, Joseph M Leonard, et al.Journal of Molecular Graphics & Modelling|January 13, 2006
Molecular graphics approach to bacterial AcrB protein-beta-lactam antibiotic molecular recognition in drug efflux mechanismRudolf Kiralj, Márcia M C FerreiraJournal of Molecular Graphics & Modelling|January 13, 2006
Exploring the potential of complex formation between a mutant DNA and the wild type protein counterpart: a MM and MD simulation approachSujata Roy, Srikanta SenJournal of Molecular Graphics & Modelling|October 23, 1998
SLASH: a program for analysing the functional groups in moleculesD A Cosgrove, P WillettJournal of Molecular Graphics & Modelling|January 26, 2006
Systematic molecular dynamics searching in a lipid bilayer: application to the glycophorin A and oncogenic ErbB-2 transmembrane domainsAndrew J Beevers, Andreas KukolJournal of Molecular Graphics & Modelling|January 18, 2006
Molecular modeling, docking and ADMET studies applied to the design of a novel hybrid for treatment of Alzheimer's diseaseCarlos H T P da Silva, Vanessa Leiria Campo, Ivone Carvalho, et al.Journal of Molecular Graphics & Modelling|February 7, 2006
Automatic atom type and bond type perception in molecular mechanical calculationsJunmei Wang, Wei Wang, Peter A Kollman, et al.Journal of Molecular Graphics & Modelling|April 11, 2008
Molecular modeling study of CodX reveals importance of N-terminal and C-terminal domain in the CodWX complex structure of Bacillus subtilisNavaneethakrishnan Krishnamoorthy, Poornima Gajendrarao, Soo Hyun Eom, et al.Journal of Molecular Graphics & Modelling|May 6, 2008
Chemical function-based pharmacophore development for novel, selective kappa opioid receptor agonistsNidhi Singh, Tammy L Nolan, Christopher R McCurdyPageof 401