Advanced Search
Display options
Filter resources
Text Availability
Article type
Publication date
Species
Language
Sex
Age
Showing 1 to 12 of 1622 entries
Sorted by: Best Match Show Resources per page
New Computational Approach to Determine Liquid-Solid Phase Equilibria of Water Confined to Slit Nanopores.

Journal of chemical theory and computation

Kaneko T, Bai J, Yasuoka K, Mitsutake A, Zeng XC.
PMID: 26584089
J Chem Theory Comput. 2013 Aug 13;9(8):3299-310. doi: 10.1021/ct400221h. Epub 2013 Jul 03.

We devise a new computational approach to compute solid-liquid phase equilibria of confined fluids. Specifically, we extend the multibaric-multithermal ensemble method with an anisotropic pressure control to achieve the solid-liquid phase equilibrium for confined water inside slit nanopores (with...

Cite
Kaneko T, Bai J, Yasuoka K, et al. New Computational Approach to Determine Liquid-Solid Phase Equilibria of Water Confined to Slit Nanopores. J Chem Theory Comput. 2013;9(8):3299-310doi: 10.1021/ct400221h.
Kaneko, T., Bai, J., Yasuoka, K., Mitsutake, A., & Zeng, X. C. (2013). New Computational Approach to Determine Liquid-Solid Phase Equilibria of Water Confined to Slit Nanopores. Journal of chemical theory and computation, 9(8), 3299-310. https://doi.org/10.1021/ct400221h
Kaneko, Toshihiro, et al. "New Computational Approach to Determine Liquid-Solid Phase Equilibria of Water Confined to Slit Nanopores." Journal of chemical theory and computation vol. 9,8 (2013): 3299-310. doi: https://doi.org/10.1021/ct400221h
Kaneko T, Bai J, Yasuoka K, Mitsutake A, Zeng XC. New Computational Approach to Determine Liquid-Solid Phase Equilibria of Water Confined to Slit Nanopores. J Chem Theory Comput. 2013 Aug 13;9(8):3299-310. doi: 10.1021/ct400221h. Epub 2013 Jul 03. PMID: 26584089.
Copy Download .nbib Format: NLM
Differential Permeability of Proton Isotopes through Graphene and Graphene Analogue Monolayer.

The journal of physical chemistry letters

Zhang Q, Ju M, Chen L, Zeng XC.
PMID: 27522866
J Phys Chem Lett. 2016 Sep 01;7(17):3395-400. doi: 10.1021/acs.jpclett.6b01507. Epub 2016 Aug 17.

Two-dimensional (2D) monolayer nanomaterials can be exploited as the thinnest membrane with distinct differential sieving properties for proton isotopes. Motivated from the experimental evidence of differential sieving proton isotopes through graphene and hexagonal boron nitrate (h-BN) monolayer, we compute...

Cite
Zhang Q, Ju M, Chen L, et al. Differential Permeability of Proton Isotopes through Graphene and Graphene Analogue Monolayer. J Phys Chem Lett. 2016;7(17):3395-400doi: 10.1021/acs.jpclett.6b01507.
Zhang, Q., Ju, M., Chen, L., & Zeng, X. C. (2016). Differential Permeability of Proton Isotopes through Graphene and Graphene Analogue Monolayer. The journal of physical chemistry letters, 7(17), 3395-400. https://doi.org/10.1021/acs.jpclett.6b01507
Zhang, Qiuju, et al. "Differential Permeability of Proton Isotopes through Graphene and Graphene Analogue Monolayer." The journal of physical chemistry letters vol. 7,17 (2016): 3395-400. doi: https://doi.org/10.1021/acs.jpclett.6b01507
Zhang Q, Ju M, Chen L, Zeng XC. Differential Permeability of Proton Isotopes through Graphene and Graphene Analogue Monolayer. J Phys Chem Lett. 2016 Sep 01;7(17):3395-400. doi: 10.1021/acs.jpclett.6b01507. Epub 2016 Aug 17. PMID: 27522866.
Copy Download .nbib Format: NLM
Activation of PERK branch of ER stress mediates homocysteine-induced BK.

Oncotarget

Sun WT, Wang XC, Mak SK, He GW, Liu XC, Underwood MJ, Yang Q.
PMID: 28881660
Oncotarget. 2017 May 09;8(31):51462-51477. doi: 10.18632/oncotarget.17721. eCollection 2017 Aug 01.

The molecular mechanism of endoplasmic reticulum (ER) stress in vascular pathophysiology remains inadequately understood. We studied the role of ER stress in homocysteine-induced impairment of coronary dilator function, with uncovering the molecular basis of the effect of ER stress...

Cite
Sun WT, Wang XC, Mak SK, et al. Activation of PERK branch of ER stress mediates homocysteine-induced BK. Oncotarget. 2017;8(31):51462-51477doi: 10.18632/oncotarget.17721.
Sun, W. T., Wang, X. C., Mak, S. K., He, G. W., Liu, X. C., Underwood, M. J., & Yang, Q. (2017). Activation of PERK branch of ER stress mediates homocysteine-induced BK. Oncotarget, 8(31), 51462-51477. https://doi.org/10.18632/oncotarget.17721
Sun, Wen-Tao, et al. "Activation of PERK branch of ER stress mediates homocysteine-induced BK." Oncotarget vol. 8,31 (2017): 51462-51477. doi: https://doi.org/10.18632/oncotarget.17721
Sun WT, Wang XC, Mak SK, He GW, Liu XC, Underwood MJ, Yang Q. Activation of PERK branch of ER stress mediates homocysteine-induced BK. Oncotarget. 2017 May 09;8(31):51462-51477. doi: 10.18632/oncotarget.17721. eCollection 2017 Aug 01. PMID: 28881660; PMCID: PMC5584261.
Copy Download .nbib Format: NLM
Research Data Explorer: Lessons Learned in Design and Development of Context-based Cohort Definition and Selection.

AMIA Joint Summits on Translational Science proceedings. AMIA Joint Summits on Translational Science

Wilcox A, Vawdrey D, Weng C, Velez M, Bakken S.
PMID: 26306267
AMIA Jt Summits Transl Sci Proc. 2015 Mar 25;2015:194-8. eCollection 2015.

Research Data eXplorer (RedX) was designed to support self-service research data queries and cohort identification from clinical research databases. The primary innovation of RedX was the electronic health record view of patient data, to provide better contextual understanding for...

Cite
Wilcox A, Vawdrey D, Weng C, et al. Research Data Explorer: Lessons Learned in Design and Development of Context-based Cohort Definition and Selection. AMIA Jt Summits Transl Sci Proc. 2015;2015:194-8
Wilcox, A., Vawdrey, D., Weng, C., Velez, M., & Bakken, S. (2015). Research Data Explorer: Lessons Learned in Design and Development of Context-based Cohort Definition and Selection. AMIA Joint Summits on Translational Science proceedings. AMIA Joint Summits on Translational Science, 2015194-8.
Wilcox, Adam, et al. "Research Data Explorer: Lessons Learned in Design and Development of Context-based Cohort Definition and Selection." AMIA Joint Summits on Translational Science proceedings. AMIA Joint Summits on Translational Science vol. 2015 (2015): 194-8.
Wilcox A, Vawdrey D, Weng C, Velez M, Bakken S. Research Data Explorer: Lessons Learned in Design and Development of Context-based Cohort Definition and Selection. AMIA Jt Summits Transl Sci Proc. 2015 Mar 25;2015:194-8. eCollection 2015. PMID: 26306267; PMCID: PMC4525259.
Copy Download .nbib Format: NLM
Predicting New Target Conditions for Drug Retesting Using Temporal Patterns in Clinical Trials: A Proof of Concept.

AMIA Joint Summits on Translational Science proceedings. AMIA Joint Summits on Translational Science

He Z, Weng C.
PMID: 26306283
AMIA Jt Summits Transl Sci Proc. 2015 Mar 25;2015:445-9. eCollection 2015.

Drug discovery is costly and time-consuming. Efficient drug repurposing promises to accelerate drug discovery with reduced cost. However, most successful repurposing cases so far have been achieved by serendipity. There is a need for more efficient computational methods for...

Cite
He Z, Weng C. Predicting New Target Conditions for Drug Retesting Using Temporal Patterns in Clinical Trials: A Proof of Concept. AMIA Jt Summits Transl Sci Proc. 2015;2015:445-9
He, Z., & Weng, C. (2015). Predicting New Target Conditions for Drug Retesting Using Temporal Patterns in Clinical Trials: A Proof of Concept. AMIA Joint Summits on Translational Science proceedings. AMIA Joint Summits on Translational Science, 2015445-9.
He, Zhe, and Weng, Chunhua. "Predicting New Target Conditions for Drug Retesting Using Temporal Patterns in Clinical Trials: A Proof of Concept." AMIA Joint Summits on Translational Science proceedings. AMIA Joint Summits on Translational Science vol. 2015 (2015): 445-9.
He Z, Weng C. Predicting New Target Conditions for Drug Retesting Using Temporal Patterns in Clinical Trials: A Proof of Concept. AMIA Jt Summits Transl Sci Proc. 2015 Mar 25;2015:445-9. eCollection 2015. PMID: 26306283; PMCID: PMC4525223.
Copy Download .nbib Format: NLM
Two-dimensional interlocked pentagonal bilayer ice: how do water molecules form a hydrogen bonding network?.

Physical chemistry chemical physics : PCCP

Zhu W, Zhao WH, Wang L, Yin D, Jia M, Yang J, Zeng XC, Yuan LF.
PMID: 27063210
Phys Chem Chem Phys. 2016 Jun 07;18(21):14216-21. doi: 10.1039/c5cp07524f. Epub 2016 Apr 11.

The plethora of ice structures observed both in bulk and under nanoscale confinement reflects the extraordinary ability of water molecules to form diverse forms of hydrogen bonding networks. An ideal hydrogen bonding network of water should satisfy three requirements:...

Cite
Zhu W, Zhao WH, Wang L, et al. Two-dimensional interlocked pentagonal bilayer ice: how do water molecules form a hydrogen bonding network?. Phys Chem Chem Phys. 2016;18(21):14216-21doi: 10.1039/c5cp07524f.
Zhu, W., Zhao, W. H., Wang, L., Yin, D., Jia, M., Yang, J., Zeng, X. C., & Yuan, L. F. (2016). Two-dimensional interlocked pentagonal bilayer ice: how do water molecules form a hydrogen bonding network?. Physical chemistry chemical physics : PCCP, 18(21), 14216-21. https://doi.org/10.1039/c5cp07524f
Zhu, Weiduo, et al. "Two-dimensional interlocked pentagonal bilayer ice: how do water molecules form a hydrogen bonding network?." Physical chemistry chemical physics : PCCP vol. 18,21 (2016): 14216-21. doi: https://doi.org/10.1039/c5cp07524f
Zhu W, Zhao WH, Wang L, Yin D, Jia M, Yang J, Zeng XC, Yuan LF. Two-dimensional interlocked pentagonal bilayer ice: how do water molecules form a hydrogen bonding network?. Phys Chem Chem Phys. 2016 Jun 07;18(21):14216-21. doi: 10.1039/c5cp07524f. Epub 2016 Apr 11. PMID: 27063210.
Copy Download .nbib Format: NLM
Hydrogen bonding and orientation effects on the accommodation of methylamine at the air-water interface.

The Journal of chemical physics

Hoehn RD, Carignano MA, Kais S, Zhu C, Zhong J, Zeng XC, Francisco JS, Gladich I.
PMID: 27276960
J Chem Phys. 2016 Jun 07;144(21):214701. doi: 10.1063/1.4950951.

Methylamine is an abundant amine compound detected in the atmosphere which can affect the nature of atmospheric aerosol surfaces, changing their chemical and optical properties. Molecular dynamics simulation results show that methylamine accommodation on water is close to unity...

Cite
Hoehn RD, Carignano MA, Kais S, et al. Hydrogen bonding and orientation effects on the accommodation of methylamine at the air-water interface. J Chem Phys. 2016;144(21):214701doi: 10.1063/1.4950951.
Hoehn, R. D., Carignano, M. A., Kais, S., Zhu, C., Zhong, J., Zeng, X. C., Francisco, J. S., & Gladich, I. (2016). Hydrogen bonding and orientation effects on the accommodation of methylamine at the air-water interface. The Journal of chemical physics, 144(21), 214701. https://doi.org/10.1063/1.4950951
Hoehn, Ross D, et al. "Hydrogen bonding and orientation effects on the accommodation of methylamine at the air-water interface." The Journal of chemical physics vol. 144,21 (2016): 214701. doi: https://doi.org/10.1063/1.4950951
Hoehn RD, Carignano MA, Kais S, Zhu C, Zhong J, Zeng XC, Francisco JS, Gladich I. Hydrogen bonding and orientation effects on the accommodation of methylamine at the air-water interface. J Chem Phys. 2016 Jun 07;144(21):214701. doi: 10.1063/1.4950951. PMID: 27276960.
Copy Download .nbib Format: NLM
B(C.

Angewandte Chemie (International ed. in English)

Zhang ZY, Liu ZY, Guo RT, Zhao YQ, Li X, Wang XC.
PMID: 28266171
Angew Chem Int Ed Engl. 2017 Mar 27;56(14):4028-4032. doi: 10.1002/anie.201700864. Epub 2017 Mar 07.

Catalytic amounts of B(C

Cite
Zhang ZY, Liu ZY, Guo RT, et al. B(C. Angew Chem Int Ed Engl. 2017;56(14):4028-4032doi: 10.1002/anie.201700864.
Zhang, Z. Y., Liu, Z. Y., Guo, R. T., Zhao, Y. Q., Li, X., & Wang, X. C. (2017). B(C. Angewandte Chemie (International ed. in English), 56(14), 4028-4032. https://doi.org/10.1002/anie.201700864
Zhang, Zi-Yu, et al. "B(C." Angewandte Chemie (International ed. in English) vol. 56,14 (2017): 4028-4032. doi: https://doi.org/10.1002/anie.201700864
Zhang ZY, Liu ZY, Guo RT, Zhao YQ, Li X, Wang XC. B(C. Angew Chem Int Ed Engl. 2017 Mar 27;56(14):4028-4032. doi: 10.1002/anie.201700864. Epub 2017 Mar 07. PMID: 28266171.
Copy Download .nbib Format: NLM
Structural Evolution of Gold Clusters Au.

The journal of physical chemistry. A

Khetrapal NS, Bulusu SS, Zeng XC.
PMID: 28267347
J Phys Chem A. 2017 Mar 30;121(12):2466-2474. doi: 10.1021/acs.jpca.7b00367. Epub 2017 Mar 21.

We performed a combined theoretical and experimental photoelectron spectroscopy study of the structural evolution of gold anion clusters Au

Cite
Khetrapal NS, Bulusu SS, Zeng XC. Structural Evolution of Gold Clusters Au. J Phys Chem A. 2017;121(12):2466-2474doi: 10.1021/acs.jpca.7b00367.
Khetrapal, N. S., Bulusu, S. S., & Zeng, X. C. (2017). Structural Evolution of Gold Clusters Au. The journal of physical chemistry. A, 121(12), 2466-2474. https://doi.org/10.1021/acs.jpca.7b00367
Khetrapal, Navneet Singh, et al. "Structural Evolution of Gold Clusters Au." The journal of physical chemistry. A vol. 121,12 (2017): 2466-2474. doi: https://doi.org/10.1021/acs.jpca.7b00367
Khetrapal NS, Bulusu SS, Zeng XC. Structural Evolution of Gold Clusters Au. J Phys Chem A. 2017 Mar 30;121(12):2466-2474. doi: 10.1021/acs.jpca.7b00367. Epub 2017 Mar 21. PMID: 28267347.
Copy Download .nbib Format: NLM
Effect of picroside II on apoptosis induced by renal ischemia/reperfusion injury in rats.

Experimental and therapeutic medicine

Wang L, Liu X, Chen H, Chen Z, Weng X, Qiu T, Liu L.
PMID: 25667634
Exp Ther Med. 2015 Mar;9(3):817-822. doi: 10.3892/etm.2015.2192. Epub 2015 Jan 20.

Renal ischemia and reperfusion (I/R) injury, which commonly occurs in kidney transplantation, is the leading cause of acute kidney injury. Picroside II possesses a wide range of pharmacological effects, including anti-apoptosis effects. In the present study, the ability of...

Cite
Wang L, Liu X, Chen H, et al. Effect of picroside II on apoptosis induced by renal ischemia/reperfusion injury in rats. Exp Ther Med. 2015;9(3):817-822doi: 10.3892/etm.2015.2192.
Wang, L., Liu, X., Chen, H., Chen, Z., Weng, X., Qiu, T., & Liu, L. (2015). Effect of picroside II on apoptosis induced by renal ischemia/reperfusion injury in rats. Experimental and therapeutic medicine, 9(3), 817-822. https://doi.org/10.3892/etm.2015.2192
Wang, Lei, et al. "Effect of picroside II on apoptosis induced by renal ischemia/reperfusion injury in rats." Experimental and therapeutic medicine vol. 9,3 (2015): 817-822. doi: https://doi.org/10.3892/etm.2015.2192
Wang L, Liu X, Chen H, Chen Z, Weng X, Qiu T, Liu L. Effect of picroside II on apoptosis induced by renal ischemia/reperfusion injury in rats. Exp Ther Med. 2015 Mar;9(3):817-822. doi: 10.3892/etm.2015.2192. Epub 2015 Jan 20. PMID: 25667634; PMCID: PMC4316970.
Copy Download .nbib Format: NLM
A Near-Infrared-Emissive Alkynyl-Protected Au24 Nanocluster.

Angewandte Chemie (International ed. in English)

Wan XK, Xu WW, Yuan SF, Gao Y, Zeng XC, Wang QM.
PMID: 26119538
Angew Chem Int Ed Engl. 2015 Aug 10;54(33):9683-6. doi: 10.1002/anie.201503893. Epub 2015 Jun 26.

An alkynyl-protected gold nanocluster [Au24(C≡CPh)14(PPh3)4](SbF6)2 has been prepared by a direct reduction method. Single-crystal X-ray diffraction reveals that the molecular structure contains a Au22 core that is made of two Au13-centered cuboctahedra that share a square face. Two staple-like...

Cite
Wan XK, Xu WW, Yuan SF, et al. A Near-Infrared-Emissive Alkynyl-Protected Au24 Nanocluster. Angew Chem Int Ed Engl. 2015;54(33):9683-6doi: 10.1002/anie.201503893.
Wan, X. K., Xu, W. W., Yuan, S. F., Gao, Y., Zeng, X. C., & Wang, Q. M. (2015). A Near-Infrared-Emissive Alkynyl-Protected Au24 Nanocluster. Angewandte Chemie (International ed. in English), 54(33), 9683-6. https://doi.org/10.1002/anie.201503893
Wan, Xian-Kai, et al. "A Near-Infrared-Emissive Alkynyl-Protected Au24 Nanocluster." Angewandte Chemie (International ed. in English) vol. 54,33 (2015): 9683-6. doi: https://doi.org/10.1002/anie.201503893
Wan XK, Xu WW, Yuan SF, Gao Y, Zeng XC, Wang QM. A Near-Infrared-Emissive Alkynyl-Protected Au24 Nanocluster. Angew Chem Int Ed Engl. 2015 Aug 10;54(33):9683-6. doi: 10.1002/anie.201503893. Epub 2015 Jun 26. PMID: 26119538.
Copy Download .nbib Format: NLM
Electron-Transport Properties of Few-Layer Black Phosphorus.

The journal of physical chemistry letters

Xu Y, Dai J, Zeng XC.
PMID: 26266491
J Phys Chem Lett. 2015 Jun 04;6(11):1996-2002. doi: 10.1021/acs.jpclett.5b00510. Epub 2015 May 14.

We perform the first-principles computational study of the effect of number of stacking layers and stacking style of the few-layer black phosphorus (BPs) on the electronic properties, including transport gap, current-voltage (i-v) relation, and differential conductance. Our computation is...

Cite
Xu Y, Dai J, Zeng XC. Electron-Transport Properties of Few-Layer Black Phosphorus. J Phys Chem Lett. 2015;6(11):1996-2002doi: 10.1021/acs.jpclett.5b00510.
Xu, Y., Dai, J., & Zeng, X. C. (2015). Electron-Transport Properties of Few-Layer Black Phosphorus. The journal of physical chemistry letters, 6(11), 1996-2002. https://doi.org/10.1021/acs.jpclett.5b00510
Xu, Yuehua, et al. "Electron-Transport Properties of Few-Layer Black Phosphorus." The journal of physical chemistry letters vol. 6,11 (2015): 1996-2002. doi: https://doi.org/10.1021/acs.jpclett.5b00510
Xu Y, Dai J, Zeng XC. Electron-Transport Properties of Few-Layer Black Phosphorus. J Phys Chem Lett. 2015 Jun 04;6(11):1996-2002. doi: 10.1021/acs.jpclett.5b00510. Epub 2015 May 14. PMID: 26266491.
Copy Download .nbib Format: NLM
Showing 1 to 12 of 1622 entries