Mannich reaction with organozinc reagents in continuous flow: experimental and computational studies. [PDF]
RSC AdvFraile-González L +3 more
europepmc +1 more source
Interplay of Semicoordination and π-Hole Bonding: The Case of Cocrystals of Group 10 (Ni, Pd, Pt) Dithiocarbonate Complexes with 1,4-Diiodotetrafluorobenzene. [PDF]
Int J Mol SciStozharova MA +4 more
europepmc +1 more source
Functionalized Fullerene Nanomaterials: Evaluating Heteroatom Identity for Enhanced Charge-Transfer and Reactivity. [PDF]
MoleculesAlhuthali AMS +3 more
europepmc +1 more source
Decoding Polyether-Cation Interactions: Computational Strategies for Agricultural Applications. [PDF]
Polymers (Basel)Damante JVJ +6 more
europepmc +1 more source
Quantum Chemical Topology Analysis of Covalent Interactions in the Hydration of F<sup>-</sup> along with the Zinc Finger of NPL4 and Its Application to the Delimitation of QM/MM Boundaries. [PDF]
ACS OmegaBahena-Méndez CE +4 more
europepmc +1 more source
Unusually Strong Cooperative Noncovalent Binding of Elemental Mercury by Protonated Melamine: A Density Functional and Coupled-Cluster Study. [PDF]
J Phys Chem ATsipis AC.
europepmc +1 more source
Enhanced crystallinity of tetrahalopyridyl (THP) derivatized compounds. [PDF]
Chem SciBegg CS +7 more
europepmc +1 more source
Computational modeling of eticyclidine drug adsorption and detection on c<sub>60</sub> based nanostructures. [PDF]
Sci RepKhafagy ES, Lila ASA, Pishnamazi M.
europepmc +1 more source
Comment on "Intramolecular Proton-Coupled Hydride Transfers with Relatively Low Activation Barriers". [PDF]
J Phys Chem AMartinelli V, Richter WE.
europepmc +1 more source
Origins of Noncovalent Interactions in Lignocellulosic Biomass and Potential Implications on Recalcitrance. [PDF]
ChemphyschemRomero-Montalvo E, Mushrif SH.
europepmc +1 more source