A

Adair, L. R., Jones, I. ORCID: https://orcid.org/0000-0002-7738-2516 and Cramer, R. ORCID: https://orcid.org/0000-0002-8037-2511 (2024) Utilising precursor ion connectivity of different charge states to improve peptide and protein identification in MS/MS analysis. Analytical Chemistry, 96 (3). pp. 985-990. ISSN 0003-2700 doi: https://doi.org/10.1021/acs.analchem.3c03061

Adak, A., Castelletto, V. ORCID: https://orcid.org/0000-0002-3705-0162, Mendes, B., Barrett, G. ORCID: https://orcid.org/0000-0003-1509-0179, Seitsonen, J. and Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926 (2024) Chirality and pH influence the self-assembly of antimicrobial Lipopeptides with diverse nanostructures. ACS Applied Bio Materials. ISSN 2576-6422 doi: https://doi.org/10.1021/acsabm.4c00664

Adak, A., Castelletto, V. ORCID: https://orcid.org/0000-0002-3705-0162, de Sousa, A., Karatzas, K.-A., Wilkinson, C., Khunti, N., Seitsonen, J. and Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926 (2024) Self-assembly and antimicrobial activity of lipopeptides containing lysine-rich tripeptides. Biomacromolecules. ISSN 1525-7797 doi: https://doi.org/10.1021/acs.biomac.3c01184

Alshammari, A. A. A., Boyd, J. W., Greaves, N., Kettle, J. G., McKendrick, J. E. ORCID: https://orcid.org/0000-0003-2275-0569, Parker, L. G., Russell, A. T., Sani, A. and Smith, C. D. ORCID: https://orcid.org/0000-0002-5911-5836 (2024) Effect of tether length on endo/exo stereoselectivity in alkene–arene meta‐photocycloaddition reactions towards the Aphidocolin/Stemodin scaffolds. European Journal of Organic Chemistry. ISSN 1099-0690 doi: https://doi.org/10.1002/ejoc.202400463

B

Basham, V., Hancock, T., Mckendrick, J. ORCID: https://orcid.org/0000-0003-2275-0569, Tessarolo, N. and Wicking, C. (2024) Chemical analysis of additives included in fully formulated oils using high-performance liquid chromatography–tandem mass spectrometry. Rapid Communications in Mass Spectrometry, 38 (5). e9682. ISSN 1097-0231 doi: https://doi.org/10.1002/rcm.9682

C

Cafiero, M. ORCID: https://orcid.org/0000-0002-4895-1783 (2024) The role of exact exchange and empirical dispersion in Density Functional Theory-based three-body non-covalent interactions. Journal of Physical Chemistry A. ISSN 1089-5639 (In Press)

Carrillo-Berdugo, I., Navas, J. and Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719 (2024) Probing the thermal resistance of solid-liquid interfaces in nanofluids with molecular dynamics. The Journal of Chemical Physics, 160 (1). 014706. ISSN 1089-7690 doi: https://doi.org/10.1063/5.0177616

Castelletto, V. ORCID: https://orcid.org/0000-0002-3705-0162, Seitsonen, J., Pollitt, A. ORCID: https://orcid.org/0000-0001-8706-5154 and Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926 (2024) Minimal peptide sequences that undergo liquid–liquid phase separation via self-coacervation or complex coacervation with ATP. Biomacromolecules. ISSN 1526-4602 doi: https://doi.org/10.1021/acs.biomac.4c00738

Castelletto, V., de Mello, L., da Silva, E. R. ORCID: https://orcid.org/0000-0001-5876-2276, Seitsonen, J. and Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926 (2024) Comparison of the self‐assembly and cytocompatibility of conjugates of Fmoc (9‐fluorenylmethoxycarbonyl) with hydrophobic, aromatic, or charged amino acids. Journal of Peptide Science. ISSN 1099-1387 doi: https://doi.org/10.1002/psc.3571

Clarke, C. J., Clayton, T., Palmer, M. J., Lovelock, K. R. J. ORCID: https://orcid.org/0000-0003-1431-269X and Licence, P. (2024) A thermophysical investigation of weakly coordinated metals in ionic liquids. Chemical Science. ISSN 2041-6539 doi: https://doi.org/10.1039/D4SC03588G

Colquhoun, H. and Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719 (2024) Numerical representations of AB-type copolymer complexes: Analysis of 1H NMR chemical shift patterns in terms of a Smith-Cantor set. Journal of Mathematical Chemistry. ISSN 1572-8897 doi: https://doi.org/10.1007/s10910-024-01614-8

D

de Mello, L. R. ORCID: https://orcid.org/0000-0001-7630-5087, Honda, T. S. B., Han, S. W., Castelletto, V., Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926, Porosk, L. ORCID: https://orcid.org/0000-0002-4664-4560, Langel, Ü. and da Silva, E. R. ORCID: https://orcid.org/0000-0001-5876-2276 (2024) Structure–activity relationships of DNA nanocarriers based on the amphipathic cell penetrating peptide transportan 10. RSC Pharmaceutics. ISSN 2976-8713 doi: https://doi.org/10.1039/D4PM00065J (In Press)

F

Ferreira, P. S., Gerbelli, B. B. ORCID: https://orcid.org/0000-0001-9300-8463, Castro-Kochi, A. C. H., Cortez, B., Castro, F. L., Cantero, J., Iribarne, F., Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926 and Alves, W. A. ORCID: https://orcid.org/0000-0002-8394-2751 (2024) Exploring the use of a lipopeptide in Dipalmitoylphosphatidylcholine monolayers for enhanced detection of Glyphosate in aqueous environments. Langmuir, 40 (26). pp. 13583-13595. ISSN 1520-5827 doi: https://doi.org/10.1021/acs.langmuir.4c01089

Fu, M., Moiseev, R. V. ORCID: https://orcid.org/0000-0002-4358-9981, Hyder, M., Hayes, W. ORCID: https://orcid.org/0000-0003-0047-2991, Amadesi, S., Williams, A. C. ORCID: https://orcid.org/0000-0003-3654-7916 and Khutoryanskiy, V. V. ORCID: https://orcid.org/0000-0002-7221-2630 (2024) Exploring mucoadhesive and toxicological characteristics following modification of linear polyethylenimine with various anhydrides. Biomacromolecules. ISSN 1526-4602 doi: https://doi.org/10.1021/acs.biomac.4c00220

G

Gousseva, E., Towers Tompkins, F. K., Seymour, J. M., Parker, L. G. ORCID: https://orcid.org/0000-0001-8727-4116, Clarke, C. J. ORCID: https://orcid.org/0000-0003-2698-3490, Palgrave, R. G. ORCID: https://orcid.org/0000-0003-4522-2486, Bennett, R. A. ORCID: https://orcid.org/0000-0001-6266-3510, Grau-Crespo, R. ORCID: https://orcid.org/0000-0001-8845-1719 and Lovelock, K. R. J. ORCID: https://orcid.org/0000-0003-1431-269X (2024) Anion-dependent strength scale of interactions in ionic liquids from x-ray photoelectron spectroscopy, ab initio molecular dynamics, and density functional theory. The Journal of Physical Chemistry B, 128 (20). pp. 5030-5043. ISSN 1520-6106 doi: https://doi.org/10.1021/acs.jpcb.4c00362

H

Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926 and Castelletto, V. ORCID: https://orcid.org/0000-0002-3705-0162 (2024) Cyclodextrin-induced suppression of the crystallization of low-molar-mass poly(ethylene glycol). ACS Polymers Au, 4 (4). pp. 266-272. ISSN 2694-2453 doi: https://doi.org/10.1021/acspolymersau.4c00024

Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926 and Castelletto, V. (2024) Sodium dodecyl sulfate micelles: accurate analysis of small-angle x-ray scattering data through form factor and atomistic molecular dynamics modelling. Colloids and Surfaces A: Physicochemical and Engineering Aspects, 696. 134394. ISSN 1873-4359 doi: https://doi.org/10.1016/j.colsurfa.2024.134394

Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926, Adak, A. and Castelletto, V. ORCID: https://orcid.org/0000-0002-3705-0162 (2024) Influence of chirality and sequence in lysine-rich lipopeptide biosurfactants and micellar model colloid systems. Nature Communications, 15. 6785. ISSN 2041-1723 doi: https://doi.org/10.1038/s41467-024-51234-8

Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926, Castelletto, V., Hermida-Merino, D. and Rosenthal, M. (2024) Cyclodextrin‐induced suppression of PEG crystallization from the melt in a PEG‐peptide conjugate. ChemBioChem. e202400396. ISSN 1439-7633 doi: https://doi.org/10.1002/cbic.202400396 (In Press)

Hayler, H. J. ORCID: https://orcid.org/0000-0002-0626-1522, Hallett, J. E. ORCID: https://orcid.org/0000-0002-9747-9980 and Perkin, S. ORCID: https://orcid.org/0000-0002-5875-5217 (2024) Hydrogen bond donors dictate the frictional response in deep eutectic solvents. Langmuir, 40 (11). pp. 5695-5700. ISSN 1520-5827 doi: https://doi.org/10.1021/acs.langmuir.3c03303

K

Krenkel, H. (2024) Advancing liquid MALDI ion source designs and applications in modern biological mass spectrometry. PhD thesis, University of Reading. doi: https://doi.org/10.48683/1926.00118319

N

Nunes, C. D., Taylor, J. O., Hartl, F. ORCID: https://orcid.org/0000-0002-7013-5360 and Calhorda, M. J. (2024) Sustainable redox catalysts with Molybdenum complexes and nanoparticles. In: Pombeiro, A. J. L., Mahmudov, K. T. and Guedes da Silva, M. d. F. C. (eds.) Metal Coordination and Nanomaterials. Synthesis and Applications in Chemistry and Materials (11). World Scientific, pp. 395-465. ISBN 9789811279935 doi: https://doi.org/10.1142/9789811283208_0012

P

Piras, C., De Fazio, R., Di Francesco, A., Oppedisano, F., Spina, A. A., Cunsolo, V., Roncada, P., Cramer, R. ORCID: https://orcid.org/0000-0002-8037-2511 and Britti, D. (2024) Detection of antimicrobial proteins/peptides and bacterial proteins involved in antimicrobial resistance in raw cow’s milk from different breeds. Antibiotics, 13 (9). 838. ISSN 2079-6382 doi: https://doi.org/10.3390/antibiotics13090838

Prieto Otoya, T. D., McQuaid, K. ORCID: https://orcid.org/0000-0002-3222-5584 and Cardin, C. ORCID: https://orcid.org/0000-0002-2556-9995 (2024) Structural Insights into G-quadruplex binding by metal complexes: implications for drug design. Medicinal Chemistry Research. ISSN 1554-8120 doi: https://doi.org/10.1007/s00044-024-03309-w

Prieto Otoya, T. D., McQuaid, K. T. ORCID: https://orcid.org/0000-0002-3222-5584, Hennessy, J., Menounou, G., Gibney, A., Paterson, N., Cardin, D. J., Kellett, A. and Cardin, C. J. ORCID: https://orcid.org/0000-0002-2556-9995 (2024) Probing a major DNA weakness: resolving the groove and sequence selectivity of the diimine complex Λ‐[Ru(phen)2phi]2+. Angewandte Chemie International Edition. ISSN 1521-3773 doi: https://doi.org/10.1002/anie.202318863

R

Rosa, E., Pellegrino, P. ORCID: https://orcid.org/0000-0001-6018-3548, Cascione, M., Rinaldi, R. ORCID: https://orcid.org/0000-0003-2798-9341, Gianolio, E. ORCID: https://orcid.org/0000-0002-7130-4445, Edwards-Gayle, C. ORCID: https://orcid.org/0000-0001-7757-107X, Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926, Morelli, G., Accardo, A. and Diaferia, C. (2024) Cross-link of telechelic diacrylate polyethylene-glycol in peptide-based Fmoc-FF hydrogel matrices. ACS Applied Polymer Materials, 6 (12). pp. 7197-7208. ISSN 2637-6105 doi: https://doi.org/10.1021/acsapm.4c01059

S

Salimi, S., Graham, A. M., Wu, Y., Song, P., Hart, L. R., Irvine, D. J., Wildman, R. D., Siviour, C. R. and Hayes, W. ORCID: https://orcid.org/0000-0003-0047-2991 (2024) An effective route to the additive manufacturing of a mechanically gradient supramolecular polymer nanocomposite structure. Journal of the Mechanical Behavior of Biomedical Materials, 150. 106358. ISSN 1878-0180 doi: https://doi.org/10.1016/j.jmbbm.2023.106358

Schulze, C. A. E. and Cafiero, M. ORCID: https://orcid.org/0000-0002-4895-1783 (2024) Pairwise additivity and three-body contributions for Density Functional Theory-based protein-ligand interaction energies. Journal of Physical Chemistry B, 128 (10). pp. 2326-2336. ISSN 1520-5207 doi: https://doi.org/10.1021/acs.jpcb.3c07456

Seymour, J., Gousseva, E., Towers Tompkins, F., Parker, L., Alblewi, N., Clarke, C. J., Hayama, S., Palgrave, R., Bennett, R. ORCID: https://orcid.org/0000-0001-6266-3510, Matthews, R. P. and Lovelock, K. R. J. ORCID: https://orcid.org/0000-0003-1431-269X (2024) Unravelling the complex speciation of halozincate ionic liquids using X-ray spectroscopies and calculations. Faraday Discussions. ISSN 1359-6640 doi: https://doi.org/10.1039/D4FD00029C (In Press)

Shatabayeva, E. ORCID: https://orcid.org/0000-0001-9153-5198, Kaldybekov, D. B. ORCID: https://orcid.org/0000-0002-7191-5465, Ulmanova, L., Zhaisanbayeva, B. A., Mun, E. A., Kenessova, Z. A. ORCID: https://orcid.org/0000-0003-2768-824X, Kudaibergenov, S. E. and Khutoryanskiy, V. V. ORCID: https://orcid.org/0000-0002-7221-2630 (2024) Enhancing mucoadhesive properties of gelatin through chemical modification with unsaturated anhydrides. Biomacromolecules. ISSN 1526-4602 doi: https://doi.org/10.1021/acs.biomac.3c01183

Shi, Z., Hyder, M., Tareq, A. Z., Chippindale, A. M. ORCID: https://orcid.org/0000-0002-5918-8701, Cooper, J. A. ORCID: https://orcid.org/0000-0002-3981-9246, Harries, J. L. and Hayes, W. ORCID: https://orcid.org/0000-0003-0047-2991 (2024) Adhesive and healable supramolecular comb-polymers. Reactive and Functional Polymers, 202. 105994. ISSN 1873-166X doi: https://doi.org/10.1016/j.reactfunctpolym.2024.105994

Sumner, E., Pižl, M., McQuaid, K. T. ORCID: https://orcid.org/0000-0002-3222-5584 and Hartl, F. ORCID: https://orcid.org/0000-0002-7013-5360 (2024) Nitrile substituents at the conjugated dipyridophenazine moiety as infra-red redox markers in electrochemically reduced heteroleptic Ru(II) polypyridyl complexes. Inorganic Chemistry, 63 (5). pp. 2460-2469. ISSN 0020-1669 doi: https://doi.org/10.1021/acs.inorgchem.3c03484

T

Tareq, A. Z., Hyder, M., Hermida Merino, D., Chippindale, A. M. ORCID: https://orcid.org/0000-0002-5918-8701, Kaur, A., Cooper, J. A. ORCID: https://orcid.org/0000-0002-3981-9246 and Hayes, W. ORCID: https://orcid.org/0000-0003-0047-2991 (2024) Thermally and mechanically robust self-healing supramolecular polyurethanes featuring aliphatic amide end caps. Polymer, 302. 127052. ISSN 1873-2291 doi: https://doi.org/10.1016/j.polymer.2024.127052

Tian, Y. ORCID: https://orcid.org/0000-0001-5750-5817, Zhang, R., Cui, J., Zhu, Y., Sun, M., Hamley, I. W. ORCID: https://orcid.org/0000-0002-4549-0926, Xiao, C. ORCID: https://orcid.org/0000-0001-7936-4146 and Chen, L. ORCID: https://orcid.org/0000-0001-7922-0599 (2024) An injectable antibacterial hydrogel with bacterial-targeting properties for subcutaneous suppuration treatment. Chemical Engineering Journal, 488. 151137. ISSN 1873-3212 doi: https://doi.org/10.1016/j.cej.2024.151137

Touhami, D., Mofikoya, A. O., Girling, R. D. ORCID: https://orcid.org/0000-0001-8816-8075, Langford, B., Misztal, P. K. and Pfrang, C. (2024) Atmospheric degradation of ecologically important biogenic volatiles: investigating the ozonolysis of (E)-β-ocimene, isomers of α and β-farnesene, α-terpinene and 6-methyl-5-hepten-2-one, and their gas-phase products. Journal of Chemical Ecology. ISSN 1573-1561 doi: https://doi.org/10.1007/s10886-023-01467-6

Towers Tompkins, F., Parker, L., Fogarty, R., Seymour, J., Gousseva, E., Grinter, D. C., Palgrave, R., Smith, C. D. ORCID: https://orcid.org/0000-0002-5911-5836, Bennett, R. ORCID: https://orcid.org/0000-0001-6266-3510, Matthews, R. P. and Lovelock, K. R. J. ORCID: https://orcid.org/0000-0003-1431-269X (2024) Controlling and predicting alkyl-onium electronic structure. Chemical Communications. ISSN 1359-7345 doi: https://doi.org/10.1039/D4CC03388D (In Press)

V

Vaqueiro, P. ORCID: https://orcid.org/0000-0001-7545-6262, ed. (2024) Advanced thermoelectric materials and devices. ACS Applied Electronic Materials. American Chemical Society. doi: https://doi.org/10.1021/acsaelm.4c00811 (In Press) ((Special Issue))

Y

Yang, X. F., Zhang, M.-X., Liu, S. H. and Hartl, F. ORCID: https://orcid.org/0000-0002-7013-5360 (2024) Metallaaromatic complexes as candidates for future molecular materials and electronic devices: recent advancements. Chemistry - An Asian Journal, 19 (2). e202300860. ISSN 1861-471X doi: https://doi.org/10.1002/asia.202300860