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  • Currently displaying 3041 - 3060 of 29877 publications
Author(s)
Publication title
Journal Name
Publication year
RSC CICAG Open Chemical Science meeting: integrating chemical data from two symposia and a series of workshops
CJ Swain, JG Frey, JM Goodman
Pure and Applied Chemistry
(2022)
94
An accurate and transferable machine learning potential for carbon (voL 153, 034702, 2020)
P Rowe, VL Deringer, P Gasparotto, G Csányi, A Michaelides
The Journal of chemical physics
(2022)
156
The Limited Palette for Photonic Block-Copolymer Materials: A Historical Problem or a Practical Limitation?
Z Wang, C Chan, R Parker, S Vignolini
Angewandte Chemie (International ed. in English)
(2022)
61
The Limited Palette for Photonic Block-Copolymer Materials: A Historical Problem or a Practical Limitation?
Z Wang, CLC Chan, RM Parker, S Vignolini
Angew Chem Weinheim Bergstr Ger
(2022)
134
Author Correction: Droplet microfluidics for the highly controlled synthesis of branched gold nanoparticles.
S Abalde-Cela, P Taladriz-Blanco, MG de Oliveira, C Abell
Sci Rep
(2022)
12
Cohort-based long-term ozone exposure-associated mortality risks with adjusted metrics: A systematic review and meta-analysis.
HZ Sun, P Yu, C Lan, MWL Wan, S Hickman, J Murulitharan, H Shen, L Yuan, Y Guo, AT Archibald
Innovation
(2022)
3
Squalamine and trodusquemine: two natural products for neurodegenerative diseases, from physical chemistry to the clinic
R Limbocker, S Errico, D Barbut, TPJ Knowles, M Vendruscolo, F Chiti, M Zasloff
Natural Product Reports: a journal of current development in bioorganic chemistry
(2022)
39
Physico-Chemical Characterisation of Disease-Related Protein-Protein Interactions in Solution
M Schneider
(2022)
On the capacity and superposition of minima in neural network loss function landscapes
MP Niroomand, JWR Morgan, CT Cafolla, DJ Wales
Machine Learning Science and Technology
(2022)
3
Crystal Forms of the Antihypertensive Drug Irbesartan: A Crystallographic, Spectroscopic, and Hirshfeld Surface Analysis Investigation.
AM Araya-Sibaja, C Fandaruff, AM Guevara-Camargo, F Vargas-Huertas, WJ Zamora, JR Vega-Baudrit, T Guillén-Girón, M Navarro-Hoyos, P Paoli, P Rossi, W Jones
ACS Omega
(2022)
7
Perpendicular and Parallel Phase Separation in Two Species Driven Diffusive Lattice Gases
H Yu, K Thijssen, RL Jack
(2022)
Making the most of data: Quantum Monte Carlo postanalysis revisited.
T Ichibha, VA Neufeld, K Hongo, R Maezono, AJW Thom
Physical Review E: Statistical, Nonlinear, and Soft Matter Physics
(2022)
105
Ibrutinib Inhibits BMX-Dependent Endothelial VCAM-1 Expression In Vitro and Pro-Atherosclerotic Endothelial Activation and Platelet Adhesion In Vivo
TCL Kohs, SR Olson, J Pang, KR Jordan, TJ Zheng, A Xie, J Hodovan, M Muller, C McArthur, J Johnson, BB Sousa, M Wallisch, P Kievit, JE Aslan, JD Seixas, GJL Bernardes, MT Hinds, JR Lindner, OJT McCarty, C Puy, JJ Shatzel
Cellular and Molecular Bioengineering
(2022)
15
Beyond Platonic: How to Build Metal-Organic Polyhedra Capable of Binding Low-symmetry, Information-rich Molecular Cargoes
CT McTernan, JA Davies, JR Nitschke
Chem Rev
(2022)
122
Full configuration interaction quantum Monte Carlo treatment of fragments embedded in a periodic mean field.
EM Christlmaier, D Kats, A Alavi, D Usvyat
Journal of Chemical Physics
(2022)
156
Thermodynamically Driven Synthetic Optimization for Cation‐Disordered Rock Salt Cathodes
Z Cai, Y Zhang, Z Lun, B Ouyang, LC Gallington, Y Sun, H Hau, Y Chen, MC Scott, G Ceder
Advanced Energy Materials
(2022)
12
A Kinetic Map of the Influence of Biomimetic Lipid Membrane Models on Aβ42Aggregation
KN Baumann, M Sanguanini, O Rimon, G Šneiderienė, H Greer, D Thacker, M Schneider, S Linse, TPJ Knowles, M Vendruscolo
(2022)
Energy Landscapes for Base-Flipping in a Model DNA Duplex
Nicy, D Chakraborty, DJ Wales
Journal of Physical Chemistry B
(2022)
126
A nano-magnetic size selective cfDNA extraction platform for liquid biopsy with enhanced precision.
Y Liu, L Cheng, G Wang, J Lv, Y He, P-L Shao, R Hu, H Xiao, J Tang, D Niu, J Yang, Z Tang, Z Xu, Y Liu, Y Li, K Song, B Wu, B Zhang
Journal of Chromatography B
(2022)
1199
Augmented Hill-Climb increases reinforcement learning efficiency for language-based de novo molecule generation
M Thomas, NM O'Boyle, A Bender, C de Graaf
(2022)