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 2961 - 2980 of 30197 publications
Author(s)
Publication title
Journal Name
Publication year
Chapter Fourteen Convergence of Møller–Plesset perturbation theory for excited reference states
D-G Oprea, HGA Burton
(2023)
88
Introduction
D Frenkel, B Smit
(2023)
Exploring the chemical space of phenyl sulfide oxidation by automated optimization
P Mueller, A Vriza, AD Clayton, OS May, N Govan, S Notman, SV Ley, TW Chamberlain, RA Bourne
Reaction Chemistry and Engineering
(2023)
8
Invited speaker Kinetics of protein phase transitions
T Knowles
EUROPEAN BIOPHYSICS JOURNAL WITH BIOPHYSICS LETTERS
(2023)
52
Targeted delivery of nanoparticles to a heterogeneous crude oil zone in an unsaturated porous medium
N Jaberi, S Linley, NR Thomson
Environmental Science: Water Research & Technology
(2023)
9
Development of novel lysine targeting covalent inhibitors for Bruton’s tyrosine kinase and casein kinase 2 and synthesis of novel hybrid androgen receptor inhibitors
RC Bizga Nicolescu
(2023)
Free energy of chain molecules
D Frenkel, B Smit
(2023)
Molecular Dynamics simulations
D Frenkel, B Smit
(2023)
Chapter 7 Molecular Dynamics in various ensembles
D Frenkel, B Smit
(2023)
In silico prediction of protodeboronation by a mechanistic DFT-aided algorithm
DS Wigh, M Tissot, P Pasau, JM Goodman, AA Lapkin
Aiche Annual Meeting Conference Proceedings
(2023)
2023-November
Chapter 14 Time-scale-separation problems in MD
D Frenkel, B Smit
(2023)
Enantioselective C-C bond formation in complex multicatalytic systems
L Veth, P Dydio
(2023)
73
Using Transcriptomics and Cell Morphology Data in Drug Discovery: The Long Road to Practice
L-L Pruteanu, A Bender
ACS MEDICINAL CHEMISTRY LETTERS
(2023)
14
Chapter 8 Free-energy calculations
D Frenkel, B Smit
(2023)
Temperature dependent fabrication of various rod and rhombohedral-shaped mesoporous Co3O4 crystals and their capability towards elimination of toxic Cr(vi) ions from the aquatic environment
U Sengupta, A Mukherjee, M Periyasamy, S Mukhopadhyay, KJ Jenkinson, AEH Wheatley, A Kar
New Journal of Chemistry
(2023)
47
Direct surface analysis mass spectrometry uncovers the vertical distribution of cuticle-associated metabolites in plants
S Saladin, S D'Aronco, G Ingram, C Giorio
RSC Advances
(2023)
13
Under pressure: offering fundamental insight into structural changes on ball milling battery materials
LL Driscoll, EH Driscoll, B Dong, FN Sayed, JN Wilson, CA O'Keefe, DJ Gardner, CP Grey, PK Allan, AAL Michalchuk, PR Slater
ENERGY & ENVIRONMENTAL SCIENCE
(2023)
16
The power of an open mind
S Vignolini
PHYSICS WORLD
(2023)
36
Elucidating the effect of proteoforms on the pathogenic aggregation of α-synuclein
A Rontgen, Z Toprakcioglu, S Dada, M Vendruscolo
FEBS OPEN BIO
(2023)
13
Understanding the limits of Li-NMC811 half-cells
RC McNulty, E Hampson, LN Cutler, CP Grey, WM Dose, LR Johnson
Journal of Materials Chemistry A
(2023)
11