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Published in 2018 at "Journal of Thermal Analysis and Calorimetry"
DOI: 10.1007/s10973-018-7553-8
Abstract: Bisoprolol fumarate is a beta blocker-type drug substance which has been well known for several decades. However, no relevant data can be found in the literature about its crystal polymorphism. The purpose of this paper…
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Keywords:
form form;
polymorphic forms;
bisoprolol fumarate;
form ... See more keywords
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Published in 2021 at "Pharmaceutical Research"
DOI: 10.1007/s11095-021-03048-2
Abstract: Purpose Application of multi-scale modelling workflows to characterise polymorphism in ritonavir with regard to its stability, bioavailability and processing. Methods Molecular conformation, polarizability and stability are examined using quantum mechanics (QM). Intermolecular synthons, hydrogen bonding,…
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Keywords:
solid state;
polymorphic forms;
surface;
state surface ... See more keywords
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Published in 2021 at "Molecular pharmaceutics"
DOI: 10.1021/acs.molpharmaceut.1c00727
Abstract: Terahertz time-domain spectroscopy (THz-TDS) is applied to two polymorphs of acetylsalicylic acid (aspirin), and the experimental spectra are compared to lattice dynamical calculations using high accuracy density functional theory. The calculations confirm that forms I…
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Keywords:
disorder;
thz tds;
frequency vibrational;
polymorphic forms ... See more keywords
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Published in 2022 at "ACS Omega"
DOI: 10.1021/acsomega.1c06967
Abstract: Three polymorphic structures of mefenamic acid, which is a very popular drug, have been studied using quantum chemical methods. It has been shown that the centrosymmetric dimer formed due to two O–H···O hydrogen bonds is…
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Keywords:
structure;
polymorphic forms;
energy;
mefenamic acid ... See more keywords
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Published in 2022 at "Faraday discussions"
DOI: 10.1039/d1fd00112d
Abstract: Para amino benzoic acid (PABA) has two well-characterised α- and β-polymorphic forms and, whilst both crystallise in the monoclinic space group P21/n, they have quite different crystal chemistry and crystallisability behaviour. Previous work has shown…
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Keywords:
crystallisation;
state;
polymorphic forms;
form ... See more keywords
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Published in 2023 at "Biomedicines"
DOI: 10.3390/biomedicines11051324
Abstract: The structural transformation producing amyloids is a phenomenon that sheds new light on the protein folding problem. The analysis of the polymorphic structures of the α-synuclein amyloid available in the PDB database allows analysis of…
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Keywords:
polymorphic forms;
synuclein amyloid;
specificity polymorphic;
micelle like ... See more keywords