PolarEyes with enhanced digital imaging, a high-throughput solution for locating and grading crystals.

IF 2.8 3区 材料科学 Q1 Biochemistry, Genetics and Molecular Biology
Journal of Applied Crystallography Pub Date : 2026-09-25 eCollection Date: 2026-10-01 DOI:10.1107/S1600576726007727
Thomas D Smith, Alexandra Longcake, Michael J Hall, Michael R Probert
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引用次数: 0

Abstract

The long-range internal order of crystals enables them to exhibit a well known and long-exploited phenomenon: birefringence. Simple assessment of the interaction of crystals with a polarized light source has guided the hand of many crystallographers through history in matters of crystal selection. Historically the interaction of plane-polarized light has been analysed manually by the user. However, adapting the use of a motorized polarized light microscope to a modern small-molecule-optimized high-throughput workflow can allow for more efficient screening of crystals, in turn alleviating the analysis bottleneck previously encountered in parallel crystallization techniques, such as encapsulated nanodroplet crystallization. Presented herein are developments to an existing open-source imaging robot, including the novel integration of a commercial imaging device and a new software suite for analysis. The open-source program PolarEyes is presented for the extraction of polarization quantities from optical light micrographs. Included in PolarEyes are facilities to perform normalization against a background image and false-colour visualization using the hue, saturation, luminance colour model, and capabilities to perform analysis of multiple different incident polarization states.

PolarEyes具有增强的数字成像,用于定位和分级晶体的高通量解决方案。
晶体的长程内部秩序使它们能够表现出一种众所周知且长期被利用的现象:双折射。对晶体与偏振光源相互作用的简单评估,指导了许多晶体学家在晶体选择方面的历史。历史上,平面偏振光的相互作用是由用户手工分析的。然而,将电动偏振光显微镜的使用与现代小分子优化的高通量工作流程相适应,可以更有效地筛选晶体,从而缓解先前在平行结晶技术(如封装纳米液滴结晶)中遇到的分析瓶颈。本文介绍了对现有开源成像机器人的开发,包括商业成像设备的新集成和用于分析的新软件套件。开源程序PolarEyes提出了提取偏振量从光学光学显微照片。PolarEyes包含了对背景图像执行归一化和使用色调、饱和度、亮度颜色模型的假彩色可视化的功能,以及对多个不同入射偏振状态执行分析的功能。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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来源期刊
CiteScore
10.00
自引率
3.30%
发文量
178
审稿时长
4.7 months
期刊介绍: Many research topics in condensed matter research, materials science and the life sciences make use of crystallographic methods to study crystalline and non-crystalline matter with neutrons, X-rays and electrons. Articles published in the Journal of Applied Crystallography focus on these methods and their use in identifying structural and diffusion-controlled phase transformations, structure-property relationships, structural changes of defects, interfaces and surfaces, etc. Developments of instrumentation and crystallographic apparatus, theory and interpretation, numerical analysis and other related subjects are also covered. The journal is the primary place where crystallographic computer program information is published.
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