Publications
Manuel S. Drehwald, Asma Jamali, and Rodrigo A. Vargas-Hernández, “MOLPIPx: An end-to-end differentiable package for Permutationally Invariant Polynomials in Python and Rust”, J. Chem. Phys. 162, 084115 (2025). DOI: 10.1063/5.0250837
Manuel S. Drehwald, Asma Jamali, and Rodrigo A. Vargas-Hernández, “MOLPIPx: An end-to-end differentiable package for Permutationally Invariant Polynomials in Python and Rust”, J. Chem. Phys. 162, 084115 (2025). DOI: 10.1063/5.0250837