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Solvation Free Energies of Anions: From Curated Reference Data to Predictive Models2025 Journal of the American Chemical Society article Computer Science Computational Drug Discovery Methods Open access
Thomas Nevolianis, Jonathan Wenyuan Zheng, Simon Müller, Matthias Baumann, Sofja Tshepelevitsh, Ivari Kaljurand, +4 more
11citations -
Computational Characterization of Membrane Proteins as Anticancer Targets: Current Challenges and Opportunities2024 International Journal of Molecular Sciences article Computer Science Computational Drug Discovery Methods Open access
Marina Gorostiola González, Willem Jespers, Adriaan P. IJzerman, Laura H. Heitman, Gerard J. P. van Westen
3citations
4 results