Tips on using this search form

  • All search terms are case-insensitive
  • If you specify more than one search option (e.g. you search for both "Authors" and "Paper title") then the publications returned will be those that match all of your search terms
  • To reset the search form, click here
  • Currently displaying 7621 - 7640 of 30136 publications
Author(s)
Publication title
Journal Name
Publication year
ISA-Pol: distributed polarizabilities and dispersion models from a basis-space implementation of the iterated stockholder atoms procedure
AJ Misquitta, AJ Stone
Theoretical Chemistry Accounts
(2018)
137
Combined Virtual/Experimental Multicomponent Solid Forms Screening of Sildenafil: New Salts, Cocrystals, and Hybrid Salt-Cocrystals
R Barbas, M Font-Bardia, A Paradkar, CA Hunter, R Prohens
Crystal Growth and Design
(2018)
18
Analysis of the Ub to Ub-CR transition in ubiquitin
K Röder, DJ Wales
Biochemistry
(2018)
57
Posttranslational Chemical Mutagenesis: To Reveal the Role of Noncatalytic Cysteine Residues in Pathogenic Bacterial Phosphatases
JB Bertoldo, H Terenzi, S Hüttelmaier, GJL Bernardes
Biochemistry
(2018)
57
Understanding the Influence of Surface Solvation and Structure on Polymorph Stability: A Combined Mechanochemical and Theoretical Approach
AM Belenguer, GI Lampronti, N De Mitri, M Driver, CA Hunter, JKM Sanders
Journal of the American Chemical Society
(2018)
140
Prediction of Farnesoid X Receptor Disruptors with Machine Learning Methods.
Y Chen, H Yang, Z Wu, G Liu, Y Tang, W Li
Chemical research in toxicology
(2018)
31
From alkylarenes to anilines via site-directed carbon-carbon amination.
J Liu, X Qiu, X Huang, X Luo, C Zhang, J Wei, J Pan, Y Liang, Y Zhu, Q Qin, S Song, N Jiao
Nat Chem
(2018)
11
Strongly coloured thiocyanate frameworks with perovskite-analogue structures.
MJ Cliffe, EN Keyzer, MT Dunstan, S Ahmad, MFL De Volder, F Deschler, AJ Morris, CP Grey
Chem Sci
(2018)
10
Site-Selective Cross-Coupling of Remote Chlorides Enabled by Electrostatically-Directed Palladium Catalysis
RJ Phipps, W Golding, R Pearce-Higgins
J Am Chem Soc
(2018)
140
Investigating the Effect of Chain Connectivity on the Folding of a Beta-Sheet Protein On and Off the Ribosome.
AP Marsden, JJ Hollins, C O'Neill, P Ryzhov, S Higson, CATF Mendonça, TO Kwan, LG Kwa, A Steward, J Clarke
J Mol Biol
(2018)
430
Volcanic radiative forcing from 1979 to 2015
A Schmidt, MJ Mills, S Ghan, JM Gregory, RP Allan, T Andrews, CG Bardeen, A Conley, PM Forster, A Gettelman, RW Portmann, S Solomon, OB Toon
Journal of Geophysical Research: Atmospheres
(2018)
123
An improved methodology to compute surface site interaction points using high density molecular electrostatic potential surfaces
A Oliver, CA Hunter, R Prohens, JL Rosselló
J Comput Chem
(2018)
39
Silicon Grignard Reagents as Nucleophiles in Transition-Metal-Catalyzed Allylic Substitution
W Xue, M Oestreich
Synthesis
(2018)
51
Lattice models and Monte Carlo methods for simulating DNA origami self-assembly
A Cumberworth, A Reinhardt, D Frenkel
(2018)
Stereoselective organocatalyzed glycosylations - thiouracil, thioureas and monothiophthalimide act as Bronsted acid catalysts at low loadings
GA Bradshaw, AC Colgan, NP Allen, I Pongener, MB Boland, Y Ortin, EM McGarrigle
Chem Sci
(2018)
10
Postfunctionalization of Tris(pyridyl) Aluminate Ligands: Chirality, Coordination, and Supramolecular Chemistry
Á García‐Romero, AJ Plajer, L Álvarez‐Miguel, AD Bond, DS Wright, R García‐Rodríguez
Chemistry - A European Journal
(2018)
24
Solving the Puzzle of the Coexistence of Different Adsorption Geometries of Graphene on Ni(111)
SC Matysik, C Papp, A Görling
Journal of Physical Chemistry C
(2018)
122
A Carbon-Neutral CO2 Capture, Conversion, and Utilization Cycle with Low-Temperature Regeneration of Sodium Hydroxide
S Kar, A Goeppert, V Galvan, R Chowdhury, J Olah, GKS Prakash
Journal of the American Chemical Society
(2018)
140
Competition between Metal Dissolution and Gas Release in Li-Rich Li3RuyIr1–yO4 Model Compounds Showing Anionic Redox
Q Jacquet, A Iadecola, M Saubanère, L Lemarquis, EJ Berg, DAD Corte, G Rousse, M-L Doublet, J-M Tarascon
Chemistry of Materials
(2018)
30
Three-Component Assembly of Multiply Substituted Homoallylic Alcohols and Amines Using a Flow Chemistry Photoreactor
Y Chen, D Blakemore, P Pasau, S Ley
Organic letters
(2018)
20