TY  - JOUR

T1  - Graph Laplacian spectral descriptors for alignment-free molecular shape and electrostatic comparison

JO  - Journal of Cheminformatics

UR  - https://doi.org/10.1186/s13321-026-01310-6

PY  - 2026/10/20

AU  - Middleton J

AU  - Ghiandoni GM

AU  - Packer MJ

AU  - Zhuang M

AU  - Gillet VJ

ED  - 

DO  - DOI: 10.1186/s13321-026-01310-6

PB  - Springer Science and Business Media LLC

Y2  - 2026/11/11

ER  -