MeltR software provides facile determination of nucleic acid thermodynamics.

IF 2.4 Q3 BIOPHYSICS Biophysical reports Pub Date : 2023-06-14 DOI:10.1016/j.bpr.2023.100101
Jacob P Sieg, Sebastian J Arteaga, Brent M Znosko, Philip C Bevilacqua
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引用次数: 3

Abstract

Thermodenaturation (melting) curves of macromolecules are used to determine folding thermodynamic parameters. Notably, this insight into RNA and DNA stability underlies nearest neighbor theory and diverse structure prediction tools. Analysis of UV-detected absorbance melting curves is complex and multivariate, requiring many data preprocessing, regression, and error analysis steps. The absorbance melting curve-fitting software MeltWin, introduced in 1996, provided a consistent and facile melting curve analysis platform used in a generation of folding parameters. Unfortunately, MeltWin software is not maintained and relies on idiosyncratic choices of baselines by the user. Herein, we provide MeltR, an open-source, curve-fitting package for analysis of macromolecular thermodynamic data. The MeltR package provides the facile conversion of melting curve data to parameters provided by MeltWin while offering additional features including global fitting of data, auto-baseline generation, and two-state melting analysis. MeltR should be a useful tool for analyzing the next generation of DNA, RNA, and nonnucleic acid macromolecular melting data.

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MeltR软件提供了简便的核酸热力学测定。
利用大分子的热变性(熔化)曲线来确定折叠热力学参数。值得注意的是,这种对RNA和DNA稳定性的洞察是最近邻理论和多种结构预测工具的基础。紫外检测吸光度熔化曲线的分析是复杂和多元的,需要许多数据预处理、回归和误差分析步骤。1996年推出的吸光度熔化曲线拟合软件MeltWin提供了一个一致和方便的熔化曲线分析平台,用于生成折叠参数。不幸的是,MeltWin软件没有得到维护,并且依赖于用户对基线的特殊选择。在这里,我们提供了MeltR,一个开源的曲线拟合包,用于分析大分子热力学数据。MeltR包可以方便地将熔化曲线数据转换为MeltWin提供的参数,同时提供额外的功能,包括数据的全局拟合、自动基线生成和双态熔化分析。MeltR应该是分析下一代DNA, RNA和非核酸大分子熔融数据的有用工具。
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来源期刊
Biophysical reports
Biophysical reports Biophysics
CiteScore
2.40
自引率
0.00%
发文量
0
审稿时长
75 days
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