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  • Currently displaying 8761 - 8780 of 30639 publications
Author(s)
Publication title
Journal Name
Publication year
Nonadiabatic semiclassical dynamics in the mixed quantum-classical initial value representation.
MS Church, TJH Hele, GS Ezra, N Ananth
Journal of Chemical Physics
(2018)
148
Adsorption of Methylamine on Amorphous Ice under Interstellar Conditions. A Grand Canonical Monte Carlo Simulation Study.
RA Horváth, G Hantal, S Picaud, M Szőri, P Jedlovszky
The Journal of Physical Chemistry A
(2018)
122
Anomalous‐Diffusion‐Assisted Brightness in White Cellulose Nanofibril Membranes
MS Toivonen, OD Onelli, G Jacucci, V Lovikka, OJ Rojas, O Ikkala, S Vignolini
Advanced Materials
(2018)
30
Reaction rate theory for supramolecular kinetics: application to protein aggregation
TCT Michaels, LX Liu, S Curk, PG Bolhuis, A Saric, TPJ Knowles
(2018)
Exfoliation of Layered Na-Ion Anode Material Na2Ti3O7for Enhanced Capacity and Cyclability
MA Tsiamtsouri, PK Allan, AJ Pell, JM Stratford, G Kim, RN Kerber, PCMM Magusin, DA Jefferson, CP Grey
Chemistry of Materials
(2018)
30
Post-transcriptional labeling by using Suzuki-Miyaura cross-coupling generates functional RNA probes
MB Walunj, AA Tanpure, SG Srivatsan
Nucleic Acids Research
(2018)
46
A Synthetic Approach for the Rapid Preparation of BODIPY Conjugates and their use in Imaging of Cellular Drug Uptake and Distribution.
S Krajcovicova, J Stankova, P Dzubak, M Hajduch, M Soural, M Urban
Chemistry - A European Journal
(2018)
24
Substrate recognition and mechanism revealed by ligand-bound polyphosphate kinase 2 structures.
AE Parnell, S Mordhorst, F Kemper, M Giurrandino, JP Prince, NJ Schwarzer, A Hofer, D Wohlwend, HJ Jessen, S Gerhardt, O Einsle, PCF Oyston, JN Andexer, PL Roach
Proceedings of the National Academy of Sciences
(2018)
115
A [HN(BH═NH)2]2– Dianion, Isoelectronic with a β-Diketiminate
RJ Less, S Hanf, R García-Rodríguez, AD Bond, DS Wright
Organometallics
(2018)
37
Supramolecular Nested Microbeads as Building Blocks for Macroscopic Self-Healing Scaffolds
Z Yu, J Liu, CSY Tan, OA Scherman, C Abell
Angewandte Chemie
(2018)
130
Selective Reductive Elimination at Alkyl Palladium(IV) by Dissociative Ligand Ionization: Catalytic C(sp
M Nappi, C He, WG Whitehurst, BGN Chappell, MJ Gaunt
Angewandte Chemie - International Edition
(2018)
57
Supramolecular Nested Microbeads as Building Blocks for Macroscopic Self-Healing Scaffolds
Z Yu, J Liu, C Tan, OA Scherman, C Abell
Angewandte Chemie International Edition
(2018)
57
Reproducing Quantum Probability Distributions at the Speed of Classical Dynamics: A New Approach for Developing Force-Field Functors.
V Sundar, D Gelbwaser-Klimovsky, A Aspuru-Guzik
Journal of Physical Chemistry Letters
(2018)
9
Sticky when wet.
J Chen, A Michaelides
Nature Chemistry
(2018)
10
Author Correction: Protein-peptide association kinetics beyond the seconds timescale from atomistic simulations
F Paul, C Wehmeyer, ET Abualrous, H Wu, MD Crabtree, J Schöneberg, J Clarke, C Freund, TR Weikl, F Noé
Nature communications
(2018)
9
All 2D materials as electrodes for high power hybrid energy storage applications
K Kato, FN Sayed, G Babu, PM Ajayan
2d Materials
(2018)
5
Diophantine Approach to the Classification of Two-Dimensional Lattices: Surfaces of Face-Centered Cubic Materials.
SJ Jenkins
Langmuir : the ACS journal of surfaces and colloids
(2018)
34
Formation of Methane Hydrate in the Presence of Natural and Synthetic Nanoparticles.
SJ Cox, DJF Taylor, TGA Youngs, AK Soper, TS Totton, RG Chapman, M Arjmandi, MG Hodges, NT Skipper, A Michaelides
Journal of the American Chemical Society
(2018)
140
Is ReO3 a mixed ionic-electronic conductor? A DFT study of defect formation and migration in a BVIO3 perovskite-type oxide
JP Parras, AR Genreith-Schriever, H Zhang, MT Elm, T Norby, RA De Souza
Phys Chem Chem Phys
(2018)
20
Corneal Dystrophy Mutations Drive Pathogenesis by Targeting TGFBIp Stability and Solubility in a Latent Amyloid-forming Domain.
M Stenvang, NP Schafer, KG Malmos, A-MW Pérez, O Niembro, P Sormanni, RV Basaiawmoit, G Christiansen, M Andreasen, DE Otzen
Journal of molecular biology
(2018)
430