Results 11 to 20 of about 2,976,941 (240)
Noncovalent Interactions in the Catechol Dimer [PDF]
Noncovalent interactions play a significant role in a wide variety of biological processes and bio-inspired species. It is, therefore, important to have at hand suitable computational methods for their investigation.
Vincenzo Barone +3 more
doaj +5 more sources
Noncovalent interactions allow our world to exist [...]
Ilya G. Shenderovich
doaj +2 more sources
Noncovalent interactions are the bridge between the ideal gas abstraction and the real world [...]
Ilya G. Shenderovich
doaj +2 more sources
Noncovalent interactions in microfluidic devices [PDF]
Noncovalent interactions in microfluidic ...
Goran Vladisavljevic (1253448)
core +6 more sources
Noncovalent Interactions in Crystals
Noncovalent Interactions in Crystals (P. Gilli and G. Gilli); in: Supramolecular Chemistry: from Molecules to Nanomaterials (J.W. Steed and P.A. Gale eds.) - Volume 6: Supramolecular Materials Chemistry ABSTRACT: The over 500 000 structures collected in current crystallographic databases represent the greatest archive of noncovalent molecular ...
GILLI, Paola, GILLI, Gastone
openaire +3 more sources
Beyond Conformational Control: Effects of Noncovalent Interactions on Molecular Electronic Properties of Conjugated Polymers [PDF]
Tuning the electronic properties of polymers is of great importance in designing highly efficient organic solar cells. Noncovalent intramolecular interactions have been often used for conformational control to enhance the planarity of polymers or ...
Liu, Bin +11 more
core +2 more sources
Towards a Density-Based Description of Chemical Bonds and Noncovalent Interactions with Pauli Energy [PDF]
Chemical bonds and noncovalent interactions are extraordinarily important concepts in chemistry and beyond. Using density-based quantities to describe them has a long history in the literature, yet none can satisfactorily describe the entire spectrum of ...
Bin, Wang +6 more
core +1 more source
Visualizing the entire range of noncovalent interactions in nanocrystalline hybrid material using 3D electron diffraction [PDF]
Noncovalent interactions are essential in the formation and function of a diverse range of hybrid materials. However, reliably identifying the noncovalent interactions in nanocrystalline materials remains challenging using conventional methods such as X ...
Yi, Luo +5 more
core +2 more sources
Erythronium Bonds: Noncovalent Interactions Involving Group 5 Elements as Electron Density Acceptors [PDF]
Analyses of the Cambridge Structural Database and theoretical calculations (PBE0-D3/def2-TZVP level, atoms-in-molecules, natural bond orbital studies) prove the formation of net attractive noncovalent interactions between group 5 elements and electron ...
Giuseppe, Resnati +4 more
core +2 more sources
Probing Noncovalent Interactions in [3,3]Metaparacyclophanes
Arene-arene interactions are fundamentally important in molecular recognition. To precisely probe arene-arene interactions in cyclophanes, we designed and synthesized (2,6-phenol)paracyclophanes and (2,6-aniline)paracyclophanes that possess two aromatic rings in close proximity.
Jie Jian +6 more
openaire +5 more sources

