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Journal of Molecular Graphics & Modelling|January 14, 2025
Glipizide inhibits the glycation of alpha-crystallin: A combined in vitro and in silico approach in retinopathy managementTing Li, Bo Ma, Li Zhang, et al.Journal of Molecular Graphics & Modelling|January 14, 2025
Borophene based quasi planar nanocluster for ethanol, isobutanol, and acetone sensing: A first principle studyNima Ajalli, Forough Rezaie, Saeedeh Kamalinahad, et al.Journal of Molecular Graphics & Modelling|January 2, 2025
Structural characterization of codon 129 polymorphism in prion peptide segments (PrP127-132) using the Markov State ModelsWycliffe Omwansu, Robinson Musembi, Solomon DereseJournal of Molecular Graphics & Modelling|December 27, 2024
Synergizing GA-XGBoost and QSAR modeling: Breaking down activity aliffs in HDAC1 inhibitorsRahul D Jawarkar, Suraj Mali, Prashant K Deshmukh, et al.Journal of Molecular Graphics & Modelling|December 25, 2024
MolecularWebXR: Multiuser discussions in chemistry and biology through immersive and inclusive augmented and virtual realityFabio J Cortés Rodríguez, Gianfranco Frattini, Sittha Phloi-Montri, et al.Journal of Molecular Graphics & Modelling|March 24, 2025
Hydrogen storage in graphitic carbon nitride coordinated with boron clusters: A DFT studyBlanca Alicia Guardado Villegas, Roberto García Carrillo, Nora Aleyda García, et al.Journal of Molecular Graphics & Modelling|March 13, 2025
Unravelling the effect of successive electron injection into the smallest cyclic boron cluster, B3n (n = +2, +1, 0, -1, -2, -3) through electronic structure analysisSourav Ranjan Ghosh, Sasthi Charan Halder, Suranjana Mitra, et al.Journal of Molecular Graphics & Modelling|March 14, 2025
Mangiferin as a potential inhibitor of transthyretin fibrillogenesisGrudinina N A, Petukhov M G, Sokolov A V, et al.Journal of Molecular Graphics & Modelling|March 13, 2025
Thiazole modified covalent triazine framework as carcinogenic metabolites adsorbent: A DFT insightHasher Irshad, Muhammad Abdullah Azhar, Katrine QvortrupJournal of Molecular Graphics & Modelling|December 18, 2024
Adsorption of sulfur mustard on the transition metals (TM = Ti2+, Cr2+, Fe2+, Co2+, Ni2+, Cu2+, Zn2+) porphyrins induced in carbon nanocone (TM-PCNC): Insight from DFT calculationAhmad Saeed Hessen, Nahed Mahmood Ahmed Alsultany, Hala Bahir, et al.Pageof 408