Eigenvalues of Hückel systems of equivalent points. - Patrick W. Fowler; Arnout Ceulemans; Liviu F. Chibotaru (Discret. Math., 2000)

Oriented 2-Cell Embeddings of a Graph and Their Symmetry Classification: Generating Algorithms and Case Study of the Möbius-Kantor Graph. - Erwin Lijnen; Arnout Ceulemans (J. Chem. Inf. Model., 2004)

Topology-Aided Molecular Design: The Platonic Molecules of Genera 0 to 3. - Erwin Lijnen; Arnout Ceulemans (J. Chem. Inf. Model., 2005)

Normal Mode Analysis of Trp RNA Binding Attenuation Protein: Structure and Collective Motions. - Guang Hu; Servaas Michielssens; Samuel L. C. Moors; Arnout Ceulemans (J. Chem. Inf. Model., 2011)

Structure, stability and bonding of the leapfrog B240, ±1, ±2. - Jules Tshishimbi Muya; Bienfait Kabuyaya Isamura; Issofa Patouossa; Minh Tho Nguyen; Arnout Ceulemans (J. Comput. Chem., 2021)