Junmei Wang

TL;DR: Higher order structures formed by oligonucleotides containing guanine repeats or isoguanine repeats after annealing in solutions containing various cations are evaluated by electrospray ionization mass spectrometry (ESI-MS) and circular dichroism (CD) spectroscopy.

TL;DR: The studies suggest that ELIE is a good trade-off between efficiency and accuracy, and it is appropriate for filling the gap between the high-throughput docking and scoring methods and the rigorous but much more computationally demanding methods like free energy perturbation (FEP) or thermodynamics integration (TI) in computer-aided drug design (CADD) projects.

TL;DR: These findings inform the items required for inclusion in instruments to accurately identify high risk youths and young adults requiring SUD prevention.

TL;DR: A lipid-coated bubble model is developed that is applied to simulate the stable cavitation of the bubble in the presence of a lipid bilayer and shows that the wall shear stress generated by the bubble vibration does not induce the membrane pore formation.

TL;DR: The analysis shows that the new continuum polarizable model is consistent with B3LYP/cc-pVTZ in modeling electronic response upon variation of dielectric environment, and reasonable, and the validity to interchange the Amber van der Waals parameters between the explicit and continuum Polarizable force fields with a series of dimers is found.