Yusuf Hamied Department of Chemistry

Publications

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  • Currently displaying 6441 - 6460 of 31130 publications
Author(s)
Publication title
Journal Name
Publication year
NECI: N-Electron Configuration Interaction with an emphasis on state-of-the-art stochastic methods
K Guther, RJ Anderson, NS Blunt, NA Bogdanov, D Cleland, N Dattani, W Dobrautz, K Ghanem, P Jeszenszki, N Liebermann, GL Manni, AY Lozovoi, H Luo, D Ma, F Merz, C Overy, M Rampp, PK Samanta, LR Schwarz, JJ Shepherd, SD Smart, E Vitale, O Weser, GH Booth, A Alavi
The Journal of Chemical Physics
(2020)
153
(doi: 10.1063/5.0005754)
Predicting Heterogeneous Ice Nucleation With a Data-Driven Approach
M Fitzner, P Pedevilla, A Michaelides
(2020)
(doi: 10.21203/rs.3.rs-40394/v1)
It is Better with Salt: Aqueous Ring-Opening Metathesis Polymerization at Neutral pH
JC Foster, MC Grocott, LA Arkinstall, S Varlas, MJ Redding, SM Grayson, RK O'Reilly
J Am Chem Soc
(2020)
142
(doi: 10.1021/jacs.0c05499)
Improving double-ended transition state searches for soft-matter systems
K Röder, DJ Wales
The Journal of Chemical Physics
(2020)
153
(doi: 10.1063/5.0011829)
One-/Two-Photon Excited Cell Membrane Imaging and Tracking by a Photoactive Nanocage
Y-P Wang, K Wu, M Pan, K Li, J-T Mo, X-H Duan, H-Z He, J Shen, C-Y Su
ACS Appl Mater Interfaces
(2020)
12
(doi: 10.1021/acsami.0c08462)
Granular hydrogels for 3D bioprinting applications
W Cheng, J Zhang, J Liu, Z Yu
View
(2020)
1
(doi: 10.1002/viw.20200060)
An accurate and transferable machine learning potential for carbon
P Rowe, VL Deringer, P Gasparotto, G Csányi, A Michaelides
The Journal of Chemical Physics
(2020)
153
(doi: 10.1063/5.0005084)
A small-molecule inhibitor of the BRCA2-RAD51 interaction modulates RAD51 assembly and potentiates DNA damage-induced cell death
DE Scott, NJ Francis-Newton, ME Marsh, AG Coyne, G Fischer, T Moschetti, AR Bayly, TD Sharpe, KT Haas, L Barber, CR Valenzano, R Srinivasan, DJ Huggins, M Ehebauer, A Esposito, L Pellegrini, T Perrior, G McKenzie, TL Blundell, M Hyvönen, J Skidmore, AR Venkitaraman, C Abell
(2020)
(doi: 10.1101/2020.07.15.200709)
Real-Time Highly-Sensitive Protein Quantification Through On-Chip Chemiluminescence
HK Chiu, T Kartanas, S R. A. Devenish, K Saar, C Mouritsen Luxhøj, T Knowles
(2020)
(doi: 10.26434/chemrxiv.12646376.v1)
Genome-wide DNA Methylation Signatures Are Determined by DNMT3A/B Sequence Preferences
S-Q Mao, SM Cuesta, D Tannahill, S Balasubramanian
Biochemistry
(2020)
59
(doi: 10.1021/acs.biochem.0c00339)
Applying support-vector machine learning algorithms toward predicting host-guest interactions with cucurbit[7]uril.
A Tabet, T Gebhart, G Wu, C Readman, M Pierson Smela, VK Rana, C Baker, H Bulstrode, P Anikeeva, DH Rowitch, OA Scherman
Physical chemistry chemical physics : PCCP
(2020)
22
(doi: 10.1039/c9cp05800a)
Hydrothermal polymerization towards fully biobased polyazomethines
G Li, K Yu, J Noordijk, MHM Meeusen-Wierts, B Gebben, PAM Oude Lohuis, AHM Schotman, KV Bernaerts
Chemical Communications
(2020)
56
(doi: 10.1039/d0cc03026k)
Nanoporous Silica Preconcentrator for Vapor-Phase DMNB, a Detection Taggant for Explosives
C Day, N Rowe, T Hutter
ACS Omega
(2020)
5
(doi: 10.1021/acsomega.0c01615)
Efficient and exact sampling of transition path ensembles on Markovian networks.
DJ Sharpe, DJ Wales
The Journal of chemical physics
(2020)
153
(doi: 10.1063/5.0012128)
Quantitative Supramolecular Heterodimerization for Efficient Energy Transfer
G Wu, Z Huang, OA Scherman
Angewandte Chemie
(2020)
132
(doi: 10.1002/ange.202006530)
Quantitative Supramolecular Heterodimerization for Efficient Energy Transfer
G Wu, Z Huang, OA Scherman
Angewandte Chemie (International ed. in English)
(2020)
59
(doi: 10.1002/anie.202006530)
Phonon traces in glassy vibrations
NS Shcheblanov, ME Povarnitsyn, JD Wiles, SR Elliott, SN Taraskin
Physical Review B
(2020)
102
(doi: 10.1103/physrevb.102.024202)
A well-behaved theoretical framework for ReaxFF reactive force fields
D Furman, DJ Wales
The Journal of Chemical Physics
(2020)
153
(doi: 10.1063/5.0013906)
Emission State Structure and Linewidth Broadening Mechanisms in Type-II CdSe/CdTe Core-Crown Nanoplatelets: A Combined Theoretical-Single Nanocrystal Optical Study
V Steinmetz, JI Climente, R Pandya, J Planelles, F Margaillan, Y Puttisong, M Dufour, S Ithurria, A Sharma, G Lakhwani, L Legrand, F Bernardot, C Testelin, M Chamarro, AW Chin, A Rao, T Barisien
Journal of Physical Chemistry C
(2020)
124
(doi: 10.1021/acs.jpcc.0c04547)
Recent developments in the P y SCF program package
Q Sun, X Zhang, S Banerjee, P Bao, M Barbry, NS Blunt, NA Bogdanov, GH Booth, J Chen, Z-H Cui, JJ Eriksen, Y Gao, S Guo, J Hermann, MR Hermes, K Koh, P Koval, S Lehtola, Z Li, J Liu, N Mardirossian, JD McClain, M Motta, B Mussard, HQ Pham, A Pulkin, W Purwanto, PJ Robinson, E Ronca, ER Sayfutyarova, M Scheurer, HF Schurkus, JET Smith, C Sun, S-N Sun, S Upadhyay, LK Wagner, X Wang, A White, JD Whitfield, MJ Williamson, S Wouters, J Yang, JM Yu, T Zhu, TC Berkelbach, S Sharma, AY Sokolov, GK-L Chan
J Chem Phys
(2020)
153
(doi: 10.1063/5.0006074)
Yusuf Hamied Department of Chemistry
Lensfield Road
Cambridge
CB2 1EW
T: +44 (0) 1223 336300
enquiries@ch.cam.ac.uk
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