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Journal of Molecular Graphics & Modelling|November 10, 2022
Binding affinity prediction for antibody-protein antigen complexes: A machine learning analysis based on interface and surface areasYong Xiao Yang, Pan Wang, Bao Ting ZhuJournal of Molecular Graphics & Modelling|November 12, 2022
First-principles calculations to investigate electronic structures and magnetic regulation of non-metallic elements doped BP with point defectsJunqing Wen, Ning Li, Qiulong Shi, et al.Journal of Molecular Graphics & Modelling|August 27, 2005
Development of parameter sets for semi-empirical MO calculations of transition metal systems: iron parameters for iron-sulfur proteinsJonathan P McNamara, Mahesh Sundararajan, Ian H HillierJournal of Molecular Graphics & Modelling|January 27, 2005
Homology modelling of RNA polymerase and associated transcription factors from Bacillus subtilisIain J A MacDougall, Peter J Lewis, Renate GriffithJournal of Molecular Graphics & Modelling|January 27, 2005
Cluster analysis and three-dimensional QSAR studies of HIV-1 integrase inhibitorsHongbin Yuan, Abby ParrillJournal of Molecular Graphics & Modelling|January 27, 2005
Comparative protein modeling of methionine S-adenosyltransferase (MAT) enzyme from Mycobacterium tuberculosis: a potential target for antituberculosis drug discoverySantosh A Khedkar, Alpeshkumar K Malde, Evans C CoutinhoJournal of Molecular Graphics & Modelling|January 27, 2005
The function of the amino terminal domain in NMDA receptor modulationDavid J Huggins, Guy H GrantJournal of Molecular Graphics & Modelling|March 23, 2005
Structure analysis of the protein transduction domain of human Period1 and its mutant analogsXiao Lin Yang, Jun Xie, Bo Niu, et al.Journal of Molecular Graphics & Modelling|March 23, 2005
Inhibitor-based validation of a homology model of the active-site of tripeptidyl peptidase IIHans De Winter, Henry Breslin, Tamara Miskowski, et al.Journal of Molecular Graphics & Modelling|October 11, 2005
Barnase thermal titration via molecular dynamics simulations: detection of early denaturation sitesJian Yin, Donnell Bowen, William M SoutherlandPageof 406