Classification of intramolecular side-chain hydrogen bonds in coil fragments of globular proteins. [PDF]
Seki Y.
europepmc +1 more source
Electrosynthesis of a Metal–Organic Framework Single Crystal with Narrow Bandgap
This work demonstrates the electrosynthesis of conductive metal–organic framework (cMOF) single crystal under ambient conditions, featuring pyridine–Cd2+ coordination and 3D cross‐interpenetrating topology. TPyP‐Cd exhibits the temperature‐dependent structural evolution and semiconductivity (1.12 eV bandgap).
Xuanzi Ye+8 more
wiley +1 more source
Planarisation or a twist? Using steric engineering to unlock the origin of mechanofluorochromic red-shifts. [PDF]
McDonald PW, Goerigk L, Ritchie C.
europepmc +1 more source
External dihedral-angle error measurement based on Differential Wavefront Sensing [PDF]
Hao Yan
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A combined computational and experimental study elucidates the mechanism of the light‐induced formation of free diazoalkanes in detail. Starting from deprotonated tosylhydrazone as the light‐harvesting species, it undergoes bond dissociation from a charge transfer state.
Ferdinand L. Pointner+12 more
wiley +1 more source
Dihedral Angles and Photoluminescence Quantum Yields: An NMR Analysis [PDF]
Felix D. Goll+3 more
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Polycyclic Aromatics as Promising Phosphorescence Materials
This review focuses on the recent progress of polycyclic aromatic compounds (PACs)‐based phosphorescent materials. Their molecular structural characteristics as promising phosphors are highlighted, and the efficient strategies from molecular and aggregation levels have been illustrated systematically to promote the development of PACs with desirable ...
Peipei Liu, Qianqian Li, Zhen Li
wiley +1 more source
FakeRotLib: Expedient Noncanonical Amino Acid Parametrization in Rosetta. [PDF]
Bell EW, Brown BP, Meiler J.
europepmc +1 more source
NOE distance and dihedral angle restraints to calculate the solution structure of the NDH-1 complex subunit CupS from Thermosynechococcus elongatus. [PDF]
Korste A+4 more
europepmc +1 more source
Graph neural network for 3-dimensional structures including dihedral angles for molecular property prediction [PDF]
Sri Abhirath Reddy Sangala+1 more
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