Chemtrayzer

描述:
Chemtrayzeris a Chemical Trajectory Analyzer. 用于处理和分析化学轨迹的软件包。 Chemtrayzer用于Reaxff反应事件检测。
网站:
//sourceforge.net/projects/chemtrayzer/
参考:
如果您发现Chemtrayzer在您的研究中有用,请引用 M.Döntgen,M.-D。 Przybylski-Freund,L.C. Kröger,w.a.kopp,a.e.Ismail,K. Leonhard 使用反应分子动力学模拟自动发现反应途径,速率常数和转换状态 J.Chem。理论计算。,11(6),2517-2524,2015
执照:

麻省理工学院执照(麻省理工学院)

分发中包含的许可证

麻省理工学院执照(麻省理工学院)
Copyright (c) 2015 RWTH Aachen University

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obtaining a copy of this software and associated documentation
files (the "Software"), to deal in the Software without
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The above copyright notice and this permission notice shall be
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