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  • Currently displaying 8641 - 8660 of 29898 publications
Author(s)
Publication title
Journal Name
Publication year
Beyond Iron: Iridium-Containing P450 Enzymes for Selective Cyclopropanations of Structurally Diverse Alkenes
HM Key, P Dydio, Z Liu, JY-E Rha, A Nazarenko, V Seyedkazemi, DS Clark, JF Hartwig
ACS central science
(2017)
3
Solar H$_2$ evolution in water with modified diketopyrrolopyrrole dyes immobilised on molecular Co and Ni catalyst–TiO$_2$ hybrids
E Reisner, J warnan, J willkomm, J Ng, R godin, S Prantl, J Durrant
Chemical Science
(2017)
8
Semistochastic Heat-Bath Configuration Interaction Method: Selected Configuration Interaction with Semistochastic Perturbation Theory
S Sharma, AA Holmes, G Jeanmairet, A Alavi, CJ Umrigar
Journal of chemical theory and computation
(2017)
13
Nanoparticle assembly: A perspective and some unanswered questions
SK Kumar, G Kumaraswamy, BLV Prasad, R Bandyopadhyaya, S Granick, O Gang, VN Manoharan, D Frenkel, NA Kotov
Current Science
(2017)
112
Identification of Novel Class of Triazolo-Thiadiazoles as Potent Inhibitors of Human Heparanase and their Anticancer Activity.
CP Baburajeev, CD Mohan, S Rangappa, DJ Mason, JE Fuchs, A Bender, U Barash, I Vlodavsky, Basappa, KS Rangappa
BMC Cancer
(2017)
17
Improving Computational Predictions of Single-Stranded RNA Tetramers with Revised α/γ Torsional Parameters for the Amber Force Field.
DJ Wales, I Yildirim
The journal of physical chemistry. B
(2017)
121
Double-layer ice from first principles
J Chen, G Schusteritsch, CJ Pickard, CG Salzmann, A Michaelides
Physical Review B
(2017)
95
An Octanuclear Metallosupramolecular Cage Designed To Exhibit Spin-Crossover Behavior
N Struch, C Bannwarth, TK Ronson, Y Lorenz, B Mienert, N Wagner, M Engeser, E Bill, R Puttreddy, K Rissanen, J Beck, S Grimme, JR Nitschke, A Lützen
Angewandte Chemie (International ed. in English)
(2017)
56
Dipole-Moment Reversal in a Polar Organic Monolayer Probed by Sum and Difference Frequency Spectroscopy
NG Rey, M Sacchi, SJ Jenkins, H Arnolds
Journal of Physical Chemistry C
(2017)
121
Ein achtkerniger metallosupramolekularer Würfel mit Spin‐Crossover‐Eigenschaften
N Struch, C Bannwarth, TK Ronson, Y Lorenz, B Mienert, N Wagner, M Engeser, E Bill, R Puttreddy, K Rissanen, J Beck, S Grimme, JR Nitschke, A Lützen
Angewandte Chemie
(2017)
129
Sequence-selective encapsulation and protection of long peptides by a self-assembled Fe$^\text{II}$$_{8}$L$_{6}$ cubic cage
J Mosquera, B Szyszko, SKY Ho, JR Nitschke
Nature Communications
(2017)
8
In silico prediction of chemical subcellular localization via multi-classification methods.
H Yang, X Li, Y Cai, Q Wang, W Li, G Liu, Y Tang
RSC Medicinal Chemistry
(2017)
8
Study of device instability of bottom-gate ZnO transistors with sol-gel derived channel layers
K Yapabandara, V Mirkhani, MS Sultan, B Ozden, MP Khanal, M Park, S Wang, MC Hamilton, Y Chung, D-J Kim, MH Sk
Journal of Vacuum Science & Technology B, Nanotechnology and Microelectronics: Materials, Processing, Measurement, and Phenomena
(2017)
35
Occurrence and geographic distribution of polycyclic aromatic hydrocarbons in agricultural soils in eastern China
Z Sun, J Liu, S Zhuo, Y Chen, Y Zhang, H Shen, X Yun, G Shen, W Liu, EY Zeng, S Tao
Environ Sci Pollut Res Int
(2017)
24
Reappraisal of Polytypism in Layered Double Hydroxides: Consequences of Cation Ordering in the Metal Hydroxide Layer
L Pachayappan, S Nagendran, PV Kamath
Crystal Growth & Design
(2017)
17
Multisite aggregation of p53 and implications for drug rescue
GZ Wang, AR Fersht
Proceedings of the National Academy of Sciences of the United States of America
(2017)
114
Defining and quantifying frustration in the energy landscape: Applications to atomic and molecular clusters, biomolecules, jammed and glassy systems.
VK de Souza, JD Stevenson, SP Niblett, JD Farrell, DJ Wales
J Chem Phys
(2017)
146
Is High-Density Amorphous Ice Simply a “Derailed” State along the Ice I to Ice IV Pathway?
JJ Shephard, S Ling, GC Sosso, A Michaelides, B Slater, CG Salzmann
The journal of physical chemistry letters
(2017)
8
Synthesis, structure and paramagnetic NMR analysis of a series of lanthanide-containing [LnTi6O3(OiPr)9(salicylate)6] cages
N Li, R García-Rodríguez, PD Matthews, H-K Luo, DS Wright
Dalton Transactions
(2017)
46
Targeting low-cost type-II heterostructures: Synthesis, structure and photoreactivity
A Kar, S Sain, D Rossouw, BR Knappett, SK Pradhan, GA Botton, AEH Wheatley
Journal of Alloys and Compounds
(2017)
698