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  • Currently displaying 10881 - 10900 of 29634 publications
Author(s)
Publication title
Journal Name
Publication year
89 Constructing free energy landscapes of RNAs at atomic resolution and characterisation of their excited states.
AN Borkar, P Vallurupalli, C Camilloni, LE Kay, M Vendruscolo
Journal of Biomolecular Structure and Dynamics
(2015)
33
Metrabase: A cheminformatics and bioinformatics database for small molecule transporter data analysis and (Q)SAR modeling
L Mak, D Marcus, A Howlett, G Yarova, G Duchateau, W Klaffke, A Bender, RC Glen
Journal of Cheminformatics
(2015)
7
Multiple Redox Modes in the Reversible Lithiation of High-Capacity, Peierls-Distorted Vanadium Sulfide
S Britto, M Leskes, X Hua, C-A Hébert, HS Shin, S Clarke, O Borkiewicz, KW Chapman, R Seshadri, J Cho, CP Grey
J Am Chem Soc
(2015)
137
The Application of Ligand-Mapping Molecular Dynamics Simulations to the Rational Design of Peptidic Modulators of Protein–Protein Interactions
YS Tan, DR Spring, C Abell, CS Verma
Journal of Chemical Theory and Computation
(2015)
11
In situ NMR and electrochemical quartz crystal microbalance techniques reveal the structure of the electrical double layer in supercapacitors.
JM Griffin, AC Forse, W-Y Tsai, P-L Taberna, P Simon, CP Grey
Nature materials
(2015)
14
Effective interactions and large deviations in stochastic processes
RL Jack, P Sollich
The European Physical Journal Special Topics
(2015)
224
Structure of a single-chain Fv bound to the 17 N-terminal residues of huntingtin provides insights into pathogenic amyloid formation and suppression
E De Genst, DY Chirgadze, FAC Klein, DC Butler, D Matak-Vinković, Y Trottier, JS Huston, A Messer, CM Dobson
Journal of Molecular Biology
(2015)
427
Enantioselective and Regiodivergent Copper-Catalyzed Electrophilic Arylation of Allylic Amides with Diaryliodonium Salts.
E Cahard, HPJ Male, M Tissot, MJ Gaunt
J Am Chem Soc
(2015)
137
Genome-wide profiling of in vivo RNA structure at single-nucleotide resolution using structure-seq.
Y Ding, CK Kwok, Y Tang, PC Bevilacqua, SM Assmann
Nature Protocols
(2015)
10
Dependence on Crystal Size of the Nanoscale Chemical Phase Distribution and Fracture in LixFePO4
Y-S Yu, C Kim, DA Shapiro, M Farmand, D Qian, T Tyliszczak, ALD Kilcoyne, R Celestre, S Marchesini, J Joseph, P Denes, T Warwick, FC Strobridge, CP Grey, H Padmore, YS Meng, R Kostecki, J Cabana
Nano Letters
(2015)
15
Comparing the Influence of Simulated Experimental Errors on 12 Machine Learning Algorithms in Bioactivity Modeling Using 12 Diverse Data Sets
I Cortes-Ciriano, A Bender, TE Malliavin
Journal of Chemical Information and Modeling
(2015)
55
ChemInform Abstract: Base‐Mediated Cascade Rearrangements of Aryl‐Substituted Diallyl Ethers.
JP Reid, CA McAdam, AJS Johnston, MN Grayson, JM Goodman, MJ Cook
ChemInform
(2015)
46
Overcoming Chemical, Biological, and Computational Challenges in the Development of Inhibitors Targeting Protein-Protein Interactions
L Laraia, G McKenzie, DR Spring, AR Venkitaraman, DJ Huggins
Chemistry & biology
(2015)
22
Polarized Neutron Reflectometry of Nickel Corrosion Inhibitors.
MH Wood, RJL Welbourn, A Zarbakhsh, P Gutfreund, SM Clarke
Langmuir : the ACS journal of surfaces and colloids
(2015)
31
Different flavours of fragments
C Abell, C Dagostin
Rsc Drug Discovery Series
(2015)
47
Machines vs Malaria: A Flow-Based Preparation of the Drug Candidate OZ439.
S-H Lau, A Galván, RR Merchant, C Battilocchio, JA Souto, MB Berry, SV Ley
Organic letters
(2015)
17
Reply to "Comment on 'A Tensor-Free Method for the Structural and Dynamic Refinement of Proteins using Residual Dipolar Couplings'"
C Camilloni, M Vendruscolo
Journal of Physical Chemistry B
(2015)
119
Fundamentals of Phosphate Transfer
AJ Kirby, F Nome
Accounts of Chemical Research
(2015)
48
Enhancement of low-energy electron emission in 2D radioactive films.
A Pronschinske, P Pedevilla, CJ Murphy, EA Lewis, FR Lucci, G Brown, G Pappas, A Michaelides, ECH Sykes
Nature Materials
(2015)
14
Design of hybrid nanovehicles for remotely triggered drug release: an overview
J Liu, C Detrembleur, S Mornet, C Jérôme, E Duguet
J Mater Chem B
(2015)
3