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Currently displaying 5661 - 5680 of 29295 publications

Fragment-Based Design of Mycobacterium Tuberculosis InhA Inhibitors

M Sabbah, V Mendes, RG Vistal, DMG Dias, M Záhorszká, K Mikušová, J Korduláková, A Coyne, TL Blundell, C Abell

(2020)

In-Situ Raman Spectroscopy of Reaction Products in Optofluidic Hollow-Core Fiber Microreactors l'? 17

AS Gentleman, E Miele, T Lawson, P Köhler, S Kim, S Yousaf, DA García, A Lage, CP Grey, JJ Baumberg, MH Frosz, PSJ Russell, E Reisner, TG Euser

2020 Conference on Lasers and Electro Optics Pacific Rim CLEO PR 2020 Proceedings

(2020)

C2H_2

(doi: 10.1364/CLEOPR.2020.C2H_2)

Ionic-caged heterometallic bismuth-platinum complex exhibiting electrocatalytic CO₂ reduction (vol 49, pg 2652, 2020)

T Yoshida, H Md Ahsan, H-T Zhang, DC Izuogu, H Abe, H Ohtsu, T Yamaguchi, BK Breedlove, AJW Thom, M Yamashita

Dalton Trans

(2020)

4578

(doi: 10.1039/d0dt90053b)

Unified Prebiotically Plausible Synthesis of Pyrimidine and Purine RNA Ribonucleotides

T Carell, S Becker, J Feldmann, S Wiedemann

SYNTHESIS-STUTTGART

(2020)

A23

(doi: 10.1055/s-0039-1691149)

New approaches to study excited states in density functional theory: general discussion.

JG Brandenburg, K Burke, E Fromager, M Gatti, S Giarrusso, NI Gidopoulos, P Gori-Giorgi, D Gowland, T Helgaker, MJP Hodgson, L Lacombe, G Levi, P-F Loos, NT Maitra, E Maurina Morais, N Mehta, F Monti, MR Mulay, K Pernal, L Reining, P Romaniello, MR Ryder, A Savin, D Sirbu, AM Teale, AJW Thom, DG Truhlar, J Wetherell, W Yang

Faraday Discussions

(2020)

224

483

(doi: 10.1039/D0FD90026E)

Temperature-induced nanostructural evolution of hydrogen-rich voids in amorphous silicon: a first-principles study

P Biswas, D Paudel, R Atta-Fynn, SR Elliott

Nanoscale

(2020)

1464

(doi: 10.1039/c9nr08209c)

Mutually-dependent kinetics and energetics of photocatalyst/co-catalyst/two-redox liquid junctions

Z Pan, R Yanagi, Q Wang, X Shen, Q Zhu, Y Xue, JA Röhr, T Hisatomi, K Domen, S Hu

Energy & Environmental Science

(2020)

162

(doi: 10.1039/c9ee02910a)

A multifunnel energy landscape encodes the competing $\alpha$-helix and $\beta$-hairpin conformations for a designed peptide

D Chakraborty, Y Chebaro, DJ Wales

Phys Chem Chem Phys

(2020)

1359

(doi: 10.1039/c9cp04778f)

Quantification of Cooperativity in the Self-Assembly of H-bonded Rosettes

P Motloch, CA Hunter

Organic & biomolecular chemistry

(2020)

1602

(doi: 10.1039/d0ob00068j)

Multi-Scale Electrolyte Transport Simulations for Lithium Ion Batteries

F Hanke, N Modrow, RLC Akkermans, I Korotkin, FC Mocanu, VA Neufeld, M Veit

Journal of the Electrochemical Society

(2020)

167

013522

(doi: 10.1149/2.0222001JES)

Carbon dioxide reduction by lanthanide(iii) complexes supported by redox-active Schiff base ligands

N Jori, D Toniolo, BC Huynh, R Scopelliti, M Mazzanti

Inorganic Chemistry Frontiers

(2020)

3598

(doi: 10.1039/d0qi00801j)

Effect of the interaction strength and anisotropy on the diffusio-phoresis of spherical colloids

J Wei, S Ramírez-Hinestrosa, J Dobnikar, D Frenkel

Soft Matter

(2020)

3621

(doi: 10.1039/c9sm02053e)

Identifiable Acetylene Features Predicted for Young Earth-like Exoplanets with Reducing Atmospheres Undergoing Heavy Bombardment

PB Rimmer, M Ferus, IP Waldmann, A Knížek, D Kalvaitis, O Ivanek, P Kubelík, SN Yurchenko, T Burian, J Dostál, L Juha, R Dudžák, M Krůs, J Tennyson, S Civiš, AT Archibald, A Granville-Willett

Astrophysical Journal

(2020)

888

(doi: 10.3847/1538-4357/ab55e8)

Photocatalytic Hydrogen Generation Coupled to Pollutant Utilisation Using Carbon Dots Produced from Biomass

DS Achilleos, H Kasap, E Reisner

Green Chemistry

(2020)

2831

(doi: 10.1039/d0gc00318b)