In 1893, Alfred Werner described the structure of octahedral transition metal complexes and
provided the basis for assigning coordination number and oxidation state to what were then …

This review describes a multidimensional treatment of molecular recognition phenomena
involving aromatic rings in chemical and biological systems. It summarizes new results …

Abstract Dieser Aufsatz beschreibt Phänomene der molekularen Erkennung von
aromatischen Ringen in chemischen und biologischen Systemen in einem …

The supramolecular polymerization of 2, 11-dithia [3.3] paracyclophanes through self-
complementary intermolecular and transannular amide hydrogen bonding is presented. An …

We present a scalable cross-platform hybrid MPI/OpenMP/OpenACC implementation of the
Divide–Expand–Consolidate (DEC) formalism with portable performance on heterogeneous …

The origin of the miscibility between C60 fullerene and a series of phenyl vinyl polymers has
been investigated using a combination of wide-angle X-ray (WAXS) and neutron (WANS) …

Here, we investigated the synthetic processes for the methyl derivatives of sym-
triaminobenzene and phloroglucinol, the essential chemical reactants coming into use in the …

3, 5-Disubstituted piperidones provide an opportunity to explore donor–acceptor through-
bond interactions in the context of molecular and supramolecular structure. The crystal …

Presented is a rapid and general approach to functionalised 1-aza-adamantanetrione (AAT)
donor-σ-acceptor molecules from a phloroglucinol-derived trilactone, benzotrifuranone …

In line with increasing use of density functional theory (DFT) in quantum chemistry, it is
presently employed in more than 80% of van der Waals calculations. Since most van der …