Results 221 to 230 of about 2,372,774 (365)

Reaction force constant and projected force constants of vibrational modes along the path of an intramolecular proton transfer reaction

, 2008
Pablo Jaque, Alejandro Toro‐Labbé, Peter Politzer, Paul Geerlings   +3 more
openalex   +2 more sources

Small and Simple Molecular Structure Based Thermally Stable Ruthenium Precursor in Advancing Ruthenium ALD Process for Scaled Interconnect Metallization

Advanced Science, EarlyView.
A thermally robust (≈400 °C), critically small‐size‐simple ligand structure ruthenium (Ru) precursor enables exceptional growth per cycle (≈1.28 Å cycle−1), short incubation (≈8 cycles), ultralow resistivity (8.65 µΩ cm) and outstanding substrate selectivity via atomic layer deposition (ALD) process at high temperatures, overcoming prior Ru‐ALD ...
Hideaki Nakatsubo, Debananda Mohapatra, Eun‐Soo Lee, Jeongha Kim, Iaan Cho, Masato Iseki, Toshiyuki Shigetomi, Ryosuke Harada, Sang‐Woong Na, Taehoon Cheon, Bonggeun Shong, Soo‐Hyun Kim   +11 more
wiley   +1 more source

Effect of a Low Electrostatic Environment on the Helical Structures of Peptides and Proteins Using Flexible Water Models: An In Silico Study. [PDF]

ACS Omega
Aguilar-Pineda JA, Pérez-Aguilar J, González-Melchor M.   +2 more
europepmc   +1 more source

Emission quenching via intramolecular electron transfer for fluorescein conjugates. Dependences on driving force and medium

, 1998
Guilford Jones, Xiaohua Qian
openalex   +1 more source

Light‐Promoted Hydrazine Dehydrogenation over Ni/NH2‐MIL‐125: Unraveling Mechanisms for Efficient Hydrogen Production

Advanced Science, EarlyView.
Highly dispersed and electron‐rich Ni nanoparticles (≈2.7 nm) supported on NH2‐MIL‐125 significantly promote the dehydrogenation of hydrous hydrazine under visible‐light irradiation, achieving a turnover frequency of 220.2 h−1 at 323 K, which is more than twice that in the dark (108.1 h−1) and outperforms most reported non‐precious metal catalysts ...
Jianjun Long, Caili Hu, Qilu Yao, Kun Wang, Gang Feng, Shaowen Cao, Zhang‐Hui Lu   +6 more
wiley   +1 more source

Single-molecule mechanostructural fingerprinting of nucleic acid conformations. [PDF]

Nucleic Acids Res
Shrestha P, Bergal HT, Shih WM, Wong WP.
europepmc   +1 more source

A semiempirical free energy force field with charge‐based desolvation

Journal of Computational Chemistry, 2007
R. Huey, G. Morris, A. Olson, D. Goodsell   +3 more
semanticscholar   +1 more source

Synergistic Tuning of Conformational Dynamics, Electron Tunneling, and Substrate Positioning Enhances Electron Transfer in a P450 Chimera for Calcifediol Biosynthesis

Advanced Science, EarlyView.
A synergistic electron transfer (ET) optimization strategy modulating conformational dynamics, ET pathway, and substrate orientation is proposed for self‐sufficient cytochrome P450s. Guided by this strategy, a P450 variant with improved ET and catalytic efficiency was identified, and the underlying molecular basis was revealed by computational analysis.
Ziqi Liang, Xitong Song, Shuming Cheng, Yiwen Shen, Jie Zhang, Yaru Wang, Huiying Luo, Bin Yao, Binju Wang, Tao Tu   +9 more
wiley   +1 more source

Structural Properties of Hydrogen Fluoride in Aqueous Solution Using Reactive Force Field. [PDF]

J Phys Chem B
Uchida S, Fujiwara K, Shibahara M.
europepmc   +1 more source

Bidirectionally Thermochromic Nanocolloid System for on‐Demand Optical Switching and Agricultural Energy Management

Advanced Science, EarlyView.
A bidirectionally thermochromic nanocolloid system is developed for facility agriculture. The bidirectional and wide‐temperature response dynamically modulates light radiation, stabilizing the indoor climate, improving supplemental lighting efficiency, and accelerating plant photosynthesis.
Qinbo Jiang, Jiayi Li, Hui Zhang
wiley   +1 more source