Zero-field splitting in the isoelectronic aqueous Gd(III) and Eu(II) complexes from a first principles analysis
Sign Up to like & getrecommendations! Published in 2018 at "Chemical Physics"
DOI: 10.1016/j.chemphys.2018.02.002
Abstract: Abstract The zero-field splitting (ZFS) of the ground state octet in aqueous Eu(II) and Gd(III) solutions was investigated through multi- configurational quantum chemical calculations and ab initio molecular dynamics (AIMD) simulations. Investigation of the ZFS… read more here.
Keywords: aqueous iii; field splitting; zfs; zero field ... See more keywords
Nonlinear saturation and oscillations of collisionless zonal flows
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DOI: 10.1088/1367-2630/ab2251
Abstract: In homogeneous drift-wave turbulence, zonal flows (ZFs) can be generated via a modulational instability (MI) that either saturates monotonically or leads to oscillations of the ZF energy at the nonlinear stage. This dynamics is often… read more here.
Keywords: saturation oscillations; nonlinear saturation; zonal flows; zfs ... See more keywords
DeepZF: improved DNA-binding prediction of C2H2-zinc-finger proteins by deep transfer learning.
Sign Up to like & getrecommendations! Published in 2022 at "Bioinformatics"
DOI: 10.1093/bioinformatics/btac469
Abstract: MOTIVATION Cys2His2 zinc-finger (C2H2-ZF) proteins are the largest class of human transcription factors and hence play central roles in gene regulation and cell function. C2H2-ZF proteins are characterized by a DNA-binding domain containing multiple ZFs.… read more here.
Keywords: dna; dna binding; c2h2; transfer learning ... See more keywords
Non-Conserved Amino Acid Residues Modulate the Thermodynamics of Zn(II) Binding to Classical ββα Zinc Finger Domains
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DOI: 10.3390/ijms232314602
Abstract: Classical zinc fingers domains (ZFs) bind Zn(II) ion by a pair of cysteine and histidine residues to adopt a characteristic and stable ββα fold containing a small hydrophobic core. As a component of transcription factors,… read more here.
Keywords: classical zinc; structure; thermodynamics; zfs ... See more keywords