Crystallization Propensity of Amorphous Pharmaceuticals: Kinetics and Thermodynamics.
Sign Up to like & getrecommendations! Published in 2022 at "Molecular pharmaceutics"
DOI: 10.1021/acs.molpharmaceut.1c00839
Abstract: Four model compounds, nifedipine, indomethacin, felodipine, and ketoconazole, all with nearly identical glass transition temperatures, were chosen to study the effects of thermodynamics and molecular mobility on their crystallization propensities. The time and temperature dependence… read more here.
Keywords: crystallization propensity; time; thermodynamics; crystallization ... See more keywords
SADeepcry: a deep learning framework for protein crystallization propensity prediction using self-attention and auto-encoder networks
Sign Up to like & getrecommendations! Published in 2022 at "Briefings in bioinformatics"
DOI: 10.1093/bib/bbac352
Abstract: The X-ray diffraction (XRD) technique based on crystallography is the main experimental method to analyze the three-dimensional structure of proteins. The production process of protein crystals on which the XRD technique relies has undergone multiple… read more here.
Keywords: protein crystallization; crystallization propensity; crystallization; framework ... See more keywords
Critical evaluation of bioinformatics tools for the prediction of protein crystallization propensity
Sign Up to like & getrecommendations! Published in 2017 at "Briefings in bioinformatics"
DOI: 10.1093/bib/bbx076
Abstract: X-ray crystallography is the main tool for structural determination of proteins. Yet, the underlying crystallization process is costly, has a high attrition rate and involves a series of trial-and-error attempts to obtain diffraction-quality crystals. The… read more here.
Keywords: crystallization propensity; critical evaluation; protein crystallization; crystallization ... See more keywords