- An evaluation of machine learning/molecular mechanics end-state corrections with mechanical embedding to calculate relative protein-ligand binding free energies: J. Karwounopoulos, M. Bieniek, Z. Wu, A. L. Baskerville, G. Koenig, B. P. Cossins, G. P. F. Wood, 2024
- Insights and Challenges in Correcting Force Field Based Solvation Free Energies Using A Neural Network Potential: J. Karwounopoulos, Z. Wu, S. Tkaczyk, S. Wang, A. Baskerville, K. Ranasinghe, T. Langer, G. Wood, M. Wieder, and S. Boresch, J. Phys. Chem. B., 2024
- Correlated energy from radial density-energy relations: Adam L. Baskerville, Conor Gray and Hazel Cox, R. Soc. Open. Sci., 10, 221402, 2023
- Consequences of approximating electron correlation effects: Adam L. Baskerville and Hazel Cox, Mol. Phys., 0, e2146540, 2022
- Reparametrization of the Colle-Salvetti Formula: Adam L. Baskerville, Msugh Targema and Hazel Cox, R. Soc. Open. Sci., 9, 211333, 2022
- The bound state stability of the hydride ion in Hartree-Fock theory: Adam L. Baskerville, Hazel Cox, Ville J.J.Syrjanen and Michael Melgaard, Adv. Quant. Chem. Phys. 77, 201-240, 2020
- Electron correlation in Li+, He, H− and the critical nuclear charge system ZC: energies, densities and Coulomb holes: Adam L. Baskerville, Andrew W. King and Hazel Cox, R. Soc. Open. Sci. 6, 181357, 2019
- The quantum chemical physics of few-particle atoms and molecules: Adam L. Baskerville PhD Thesis, 1-251, 2018
- The Series Solution Method in Quantum Chemistry for Three-Particle Systems: Hazel Cox and Adam L. Baskerville, Adv. Quant. Chem. Phys. 77, 201-240, 2018
- Hartree–Fock implementation using a Laguerre-based wave function for the ground state and correlation energies of two-electron atoms: Andrew W. King, Adam L. Baskerville and Hazel Cox, Phil. Trans. R. Soc. A 376, 20170153, 2018
- Quantum effects of nuclear motion in three particle diatomic ions: Adam L. Baskerville, Andrew W. King, and Hazel Cox, Phys. Rev. A 94, 042512, 2016
Quantum Mechanics Research Scientist @ExscientiaAI