Quantum chemical design of molecular devices based on advanced materials

1994 ◽  
Author(s):  
A. Tamulis
2017 ◽  
Vol 118 (1) ◽  
pp. e25405 ◽  
Author(s):  
Baswanth Oruganti ◽  
Jun Wang ◽  
Bo Durbeej

Molecules ◽  
2018 ◽  
Vol 23 (3) ◽  
pp. 577 ◽  
Author(s):  
Yoshiki Natori ◽  
Yasutaka Kitagawa ◽  
Shogo Aoki ◽  
Rena Teramoto ◽  
Hayato Tada ◽  
...  

2015 ◽  
Vol 7 (26) ◽  
pp. 14518-14527 ◽  
Author(s):  
Chen Ling ◽  
Ruigang Zhang ◽  
Hongfei Jia

2020 ◽  
Vol 11 (1) ◽  
Author(s):  
Yeon Sik Choi ◽  
Yuan-Yu Hsueh ◽  
Jahyun Koo ◽  
Quansan Yang ◽  
Raudel Avila ◽  
...  

AbstractBioresorbable electronic stimulators are of rapidly growing interest as unusual therapeutic platforms, i.e., bioelectronic medicines, for treating disease states, accelerating wound healing processes and eliminating infections. Here, we present advanced materials that support operation in these systems over clinically relevant timeframes, ultimately bioresorbing harmlessly to benign products without residues, to eliminate the need for surgical extraction. Our findings overcome key challenges of bioresorbable electronic devices by realizing lifetimes that match clinical needs. The devices exploit a bioresorbable dynamic covalent polymer that facilitates tight bonding to itself and other surfaces, as a soft, elastic substrate and encapsulation coating for wireless electronic components. We describe the underlying features and chemical design considerations for this polymer, and the biocompatibility of its constituent materials. In devices with optimized, wireless designs, these polymers enable stable, long-lived operation as distal stimulators in a rat model of peripheral nerve injuries, thereby demonstrating the potential of programmable long-term electrical stimulation for maintaining muscle receptivity and enhancing functional recovery.


2007 ◽  
Vol 48 (8) ◽  
pp. 2148-2151 ◽  
Author(s):  
Fabio Pichierri ◽  
Mohammad Khazaei ◽  
Yoshiyuki Kawazoe

2010 ◽  
Vol 63 (3) ◽  
pp. 413 ◽  
Author(s):  
Igor Schapiro ◽  
Mikhail N. Ryazantsev ◽  
Wan Jian Ding ◽  
Mark M. Huntress ◽  
Federico Melaccio ◽  
...  

In this paper we review the results of a group of computational studies of the spectroscopy and photochemistry of light-responsive proteins. We focus on the use of quantum mechanics/molecular mechanics protocols based on a multiconfigurational quantum chemical treatment. More specifically, we discuss the use, limitations, and application of the ab initio CASPT2//CASSCF protocol that, presently, constitutes the method of choice for the investigation of excited state organic molecules, most notably, biological chromophores and fluorophores. At the end of this Review we will also see how the computational investigation of the visual photoreceptor rhodopsin is providing the basis for the design of light-driven artificial molecular devices.


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