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  • Currently displaying 5881 - 5900 of 31135 publications
Author(s)
Publication title
Journal Name
Publication year
A method of incorporating rate constants as kinetic constraints in molecular dynamics simulations.
ZF Brotzakis, M Vendruscolo, PG Bolhuis
Proc Natl Acad Sci U S A
(2020)
118
Environmental Dependence of the Structure of the C-terminal Domain of the SARS-CoV-2 Envelope Protein
K Gadhave, A Kumar, P Kumar, SK Kapuganti, N Garg, M Vendruscolo, R Giri
(2020)
Combined High-Resolution Solid-State 1H/13C NMR Spectroscopy and 1H NMR Relaxometry for the Characterization of Kerogen Thermal Maturation
F Panattoni, J Mitchell, EJ Fordham, R Kausik, CP Grey, PCMM Magusin
Energy and Fuels
(2020)
35
The method to dynamically screen and print single cells using microfluidics with pneumatic microvalves
C Chen, Y Zhu, JWK Ho, H Chen
MethodsX
(2020)
8
Single-molecule fluorescence detection of a tricyclic nucleoside analogue.
GN Samaan, MK Wyllie, JM Cizmic, L-M Needham, D Nobis, K Ngo, S Andersen, SW Magennis, SF Lee, BW Purse
Chemical science
(2020)
12
Layer-by-Layer Structural Identification of 2D Ruddlesden-Popper Hybrid Lead Iodide Perovskites by Solid-State NMR Spectroscopy
J Lee, W Lee, K Kang, T Lee, SK Lee
Chemistry of Materials
(2020)
33
Virtual hackathon to tackle COVID-19 unmet needs.
WS Bolton, S Ng, A Lam, J Kinch, V Parchment, WP Foster, MR Zimmermann, JQ Teh, A Simpson, K Sharma, R Kerstein, J Burke, SJ Chapman, PR Culmer, DG Jayne, MedTech Foundation
BMJ Innovations
(2020)
7
Equivalence between condensation and boiling in a Lennard-Jones fluid
I Sanchez-Burgos, PM de Hijes, P Rosales-Pelaez, C Vega, E Sanz
Phys Rev E
(2020)
102
Energy Landscapes for Electronic Structure
HGA Burton, DJ Wales
Journal of Chemical Theory and Computation
(2020)
17
De novo transcriptome assembly, functional annotation and characterization of the Atlantic bluefin tuna (Thunnus thynnus) larval stage.
L Marisaldi, D Basili, G Gioacchini, A Canapa, O Carnevali
Marine Genomics
(2020)
58
Interactions of α-synuclein oligomers with lipid membranes.
G Musteikytė, AK Jayaram, CK Xu, M Vendruscolo, G Krainer, TPJ Knowles
Biochimica et biophysica acta. Biomembranes
(2020)
1863
Boundary Friction of ZDDP Tribofilms
J Zhang, M Ueda, S Campen, H Spikes
Tribology Letters
(2020)
69
Does Altered Probability of Real Time Diffusional Collisions of Membrane Molecules Trigger or Delay Alzheimers Disease
D Nair, S Kedia, M Jose
iScience Notes
(2020)
5
Promises and Challenges of Next-Generation "Beyond Li-ion" Batteries for Electric Vehicles and Grid Decarbonization.
Y Tian, G Zeng, A Rutt, T Shi, H Kim, J Wang, J Koettgen, Y Sun, B Ouyang, T Chen, Z Lun, Z Rong, K Persson, G Ceder
Chem Rev
(2020)
121
Electrically-Induced Mixed Valence Causes Resistive Switching in Copper Helical Metallopolymers
JL Greenfield, D Di Nuzzo, E Evans, SP Senanayak, S Schott, JT Deacon, A Peugeot, WK Myers, H Sirringhaus, R Friend, J Nitschke
(2020)
A Magic Angle Spinning Activated 17O DNP Raser.
MA Hope, S Björgvinsdóttir, CP Grey, L Emsley
J Phys Chem Lett
(2020)
12
Germany’s Future in Theoretical and Computational Chemistry: a Special Issue Celebrating DEAL
C König, V Krewald, M Roemelt, M Rossi
International Journal of Quantum Chemistry
(2020)
121
Cover Image, Volume 121, Issue 3
D Maksimov, C Baldauf, M Rossi
International Journal of Quantum Chemistry
(2020)
121
Optimal dimensionality reduction of Markov chains using graph transformation
D Kannan, DJ Sharpe, TD Swinburne, DJ Wales
J Chem Phys
(2020)
153
Machine learning in predictive toxicology: recent applications and future directions for classification models
MWH Wang, JM Goodman, TEH Allen
Chemical research in toxicology
(2020)
34