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CP2K: An electronic structure and molecular dynamics software package - Quickstep: Efficient and accurate electronic structure calculations.
Kühne TD, Iannuzzi M, Del Ben M, Rybkin VV, Seewald P, Stein F, Laino T, Khaliullin RZ, Schütt O, Schiffmann F, Golze D, Wilhelm J, Chulkov S, Bani-Hashemian MH, Weber V, Borštnik U, Taillefumier M, Jakobovits AS, Lazzaro A, Pabst H, Müller T, Schade R, Guidon M, Andermatt S, Holmberg N, Schenter GK, Hehn A, Bussy A, Belleflamme F, Tabacchi G, Glöß A, Lass M, Bethune I, Mundy CJ, Plessl C, Watkins M, VandeVondele J, Krack M, Hutter J. Kühne TD, et al. Among authors: gloss a. J Chem Phys. 2020 May 21;152(19):194103. doi: 10.1063/5.0007045. J Chem Phys. 2020. PMID: 33687235
Benchmarking Different QM Levels for Usage with COSMO-RS.
Reinisch J, Diedenhofen M, Wilcken R, Udvarhelyi A, Glöß A. Reinisch J, et al. Among authors: gloss a. J Chem Inf Model. 2019 Nov 25;59(11):4806-4813. doi: 10.1021/acs.jcim.9b00659. Epub 2019 Nov 6. J Chem Inf Model. 2019. PMID: 31692342
The MP2-F12 method in the Turbomole program package.
Bachorz RA, Bischoff FA, Glöss A, Hättig C, Höfener S, Klopper W, Tew DP. Bachorz RA, et al. Among authors: gloss a. J Comput Chem. 2011 Aug;32(11):2492-513. doi: 10.1002/jcc.21825. Epub 2011 May 17. J Comput Chem. 2011. PMID: 21590779
The structure of magnesium alanate.
Fichtner M, Engel J, Fuhr O, Glöss A, Rubner O, Ahlrichs R. Fichtner M, et al. Among authors: gloss a. Inorg Chem. 2003 Nov 3;42(22):7060-6. doi: 10.1021/ic034160y. Inorg Chem. 2003. PMID: 14577773
A weaponized phage suppresses competitors in historical and modern metapopulations of pathogenic bacteria.
Backman T, Latorre SM, Symeonidi E, Muszyński A, Bleak E, Eads L, Martinez-Koury PI, Som S, Hawks A, Gloss AD, Belnap DM, Manuel AM, Deutschbauer AM, Bergelson J, Azadi P, Burbano HA, Karasov TL. Backman T, et al. Among authors: gloss ad. bioRxiv [Preprint]. 2024 Feb 2:2023.04.17.536465. doi: 10.1101/2023.04.17.536465. bioRxiv. 2024. PMID: 38352526 Free PMC article. Preprint.
Evolution of chemosensory and detoxification gene families across herbivorous Drosophilidae.
Peláez JN, Gloss AD, Goldman-Huertas B, Kim B, Lapoint RT, Pimentel-Solorio G, Verster KI, Aguilar JM, Nelson Dittrich AC, Singhal M, Suzuki HC, Matsunaga T, Armstrong EE, Charboneau JLM, Groen SC, Hembry DH, Ochoa CJ, O'Connor TK, Prost S, Zaaijer S, Nabity PD, Wang J, Rodas E, Liang I, Whiteman NK. Peláez JN, et al. Among authors: gloss ad. G3 (Bethesda). 2023 Aug 9;13(8):jkad133. doi: 10.1093/g3journal/jkad133. G3 (Bethesda). 2023. PMID: 37317982 Free PMC article.
Evolution of chemosensory and detoxification gene families across herbivorous Drosophilidae.
Pelaez JN, Gloss AD, Goldman-Huertas B, Kim B, Lapoint RT, Pimentel-Solorio G, Verster KI, Aguilar JM, Dittrich ACN, Singhal M, Suzuki HC, Matsunaga T, Armstrong EE, Charboneau JLM, Groen SC, Hembry DH, Ochoa CJ, O'Connor TK, Prost S, Zaaijer S, Nabity PD, Wang J, Rodas E, Liang I, Whiteman NK. Pelaez JN, et al. Among authors: gloss ad. bioRxiv [Preprint]. 2023 Mar 16:2023.03.16.532987. doi: 10.1101/2023.03.16.532987. bioRxiv. 2023. PMID: 36993186 Free PMC article. Updated. Preprint.
32 results