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  • Currently displaying 9981 - 10000 of 30425 publications
Author(s)
Publication title
Journal Name
Publication year
Sultam-Based Hetero[5]helicene: Synthesis, Structure, and Crystallization-Induced Emission Enhancement.
TS Virk, NV Ilawe, G Zhang, CP Yu, BM Wong, JMW Chan
ACS Omega
(2016)
1
Monte Carlo sampling for stochastic weight functions
D Frenkel, KJ Schrenk, S Martiniani
(2016)
pyFRET: A Python Library for Single Molecule Fluorescence Data Analysis
RR Murphy, SE Jackson, D Klenerman
Proceedings of the 7th European Conference on Python in Science (EuroSciPy 2014)
(2016)
1412
Molecular Dynamics Study of a Dual-Cation Ionomer Electrolyte.
X Chen, F Chen, E Jónsson, M Forsyth
Chemphyschem
(2016)
18
A History of the Molecular Initiating Event
TEH Allen, JM Goodman, S Gutsell, PJ Russell
Chemical research in toxicology
(2016)
29
Fe‐Catalyzed Amination of (Hetero)Arenes with a Redox‐Active Aminating Reagent under Mild Conditions
J Liu, K Wu, T Shen, Y Liang, M Zou, Y Zhu, X Li, X Li, N Jiao
Chemistry (Weinheim an der Bergstrasse, Germany)
(2016)
23
Measurements of δ13C in CH4 and using particle dispersion modeling to characterize sources of Arctic methane within an air mass
JL France, M Cain, RE Fisher, D Lowry, G Allen, SJ O'Shea, S Illingworth, J Pyle, N Warwick, BT Jones, MW Gallagher, K Bower, M Le Breton, C Percival, J Muller, A Welpott, S Bauguitte, C George, GD Hayman, AJ Manning, CL Myhre, M Lanoiselle, EG Nisbet
JOURNAL OF GEOPHYSICAL RESEARCH-ATMOSPHERES
(2016)
121
Measurements of δ$^{13}$C in CH$_{4}$ and using particle dispersion modeling to characterize sources of Arctic methane within an air mass
JL France, M Cain, RE Fisher, D Lowry, G Allen, SJ O'Shea, S Illingworth, J Pyle, N Warwick, BT Jones, MW Gallagher, K Bower, M Le Breton, C Percival, J Muller, A Welpott, S Bauguitte, C George, GD Hayman, AJ Manning, CL Myhre, M Lanoisellé, EG Nisbet
Journal of geophysical research. Atmospheres : JGR
(2016)
121
Constraints on oceanic methane emissions west of Svalbard from atmospheric in situ measurements and Lagrangian transport modeling
I Pisso, CL Myhre, SM Platt, S Eckhardt, O Hermansen, N Schmidbauer, J Mienert, S Vadakkepuliyambatta, S Bauguitte, J Pitt, G Allen, KN Bower, S O'Shea, MW Gallagher, CJ Percival, J Pyle, M Cain, A Stohl
Journal of Geophysical Research: Atmospheres
(2016)
121
Field-enhanced ion transport in solids: Reexamination with molecular dynamics simulations
AR Genreith-Schriever, RA De Souza
Physical Review B
(2016)
94
High order path integrals made easy.
V Kapil, J Behler, M Ceriotti
The Journal of Chemical Physics
(2016)
145
Finite field methods for the supercell modeling of charged insulator/electrolyte interfaces
C Zhang, M Sprik
Physical Review B
(2016)
94
Molecular Dynamics Simulation of Tau Peptides for the Investigation of Conformational Changes Induced by Specific Phosphorylation Patterns
NS Gandhi, P Kukic, G Lippens, RL Mancera
Methods in Molecular Biology
(2016)
1523
Growth of free-standing bulk wurtzite Al Ga1−N layers by molecular beam epitaxy using a highly efficient RF plasma source
SV Novikov, CR Staddon, S-L Sahonta, RA Oliver, CJ Humphreys, CT Foxon
Journal of Crystal Growth
(2016)
456
Divergent Synthesis of Quinolone Natural Products from $\textit{Pseudonocardia}$ sp. CL38489
SM Geddis, L Carro Santos, JT Hodgkinson, DR Spring
European journal of organic chemistry
(2016)
2016
Anti-mesothelioma mechanism of action studies of a complex Cynara scolymus fraction using in silico target prediction and gene expression profiling.
N Sharma, C Pulito, G Klambauer, L Mattoli, S Strano, G Blandino, J Lucci, A Bender
Planta medica
(2016)
82
Multilayering of Calcium Aerosol-OT at the Mica/Water Interface Studied with Neutron Reflection: Formation of a Condensed Lamellar Phase at the CMC.
LR Griffin, KL Browning, SY Lee, MWA Skoda, S Rogers, SM Clarke
Langmuir
(2016)
32
GPU-Accelerated Exploration of Biomolecular Energy Landscapes
RG Mantell, CE Pitt, DJ Wales
J Chem Theory Comput
(2016)
12
Structure, Thermodynamics, and Folding Pathways for a Tryptophan Zipper as a Function of Local Rigidification.
JA Joseph, CS Whittleston, DJ Wales
Journal of chemical theory and computation
(2016)
12
Coarse-Grained Simulations Complemented by Atomistic Molecular Dynamics Provide New Insights into Folding and Unfolding of Human Telomeric G-Quadruplexes.
P Stadlbauer, L Mazzanti, T Cragnolini, DJ Wales, P Derreumaux, S Pasquali, J Šponer
Journal of Chemical Theory and Computation
(2016)
12