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Locally conformally Kähler structures on unimodular Lie groups
(Springer, 2015-12)
We study left-invariant locally conformally Kähler structures on Lie groups, or equivalently, on Lie algebras. We give some properties of these structures in general, and then we consider the special cases when its complex ...
Pockets as structural descriptors of EGFR kinase conformations
(Public Library of Science, 2017-12)
Epidermal Growth Factor Receptor (EGFR), a tyrosine kinase receptor, is one of the main tumor markers in different types of cancers. The kinase native state is mainly composed of two populations of conformers: active and ...
Conformational analysis and the active conformation of N-2-phenylguanine derivatives
(Elsevier Science BvAmsterdamHolanda, 2000)
Conformational preferences induced by cyclization in orbitides: A vibrational CD study
(2022-02-14)
Orbitides are bioactive head-to-tail natural cyclic peptides from plant species. Their bioactivity is intrinsically related to the main conformations adopted in solution, whose correct characterization represents an important ...
Protein conformational diversity correlates with evolutionary rate
(Oxford University Press, 2013-04)
Native state of proteins is better represented by an ensemble of conformers in equilibrium than by only one structure. The extension of structural differences between conformers characterizes the conformational diversity ...
Protein conformational dynamics and phenotypic switching
(2021-01-01)
Intrinsically disordered proteins (IDPs) are proteins that lack rigid 3D structure but exist as conformational ensembles. Because of their structural plasticity, they can interact with multiple partners. The protein ...
CoDNaS: a database of conformational diversity in the native state of proteins
(Oxford University Press, 2013-10)
Motivation: Conformational diversity is a key concept in the understanding of different issues related with protein function such as the study of catalytic processes in enzymes, protein-protein recognition, protein evolution ...
Protein conformational diversity modulates sequence divergence
(Oxford University Press, 2012-03)
It is well established that the conservation of protein structure during evolution constrains sequence divergence. The conservation of certain physicochemical environments to preserve protein folds and then the biological ...
Modelling polymers with side chains: MEH-PPV and P3HT
(2013-04-01)
Modelling polymers with side chains is always a challenge once the degrees of freedom are very high. In this study, we present a successful methodology to model poly[2-methoxy-5-(2′-ethyl-hexyloxy)-p-phenylenevinylene] ...