Author:
Dolomanov Oleg V.,Bourhis Luc J.,Gildea Richard J.,Howard Judith A. K.,Puschmann Horst
Abstract
New software,OLEX2, has been developed for the determination, visualization and analysis of molecular crystal structures. The software has a portable mouse-driven workflow-oriented and fully comprehensive graphical user interface for structure solution, refinement and report generation, as well as novel tools for structure analysis.OLEX2seamlessly links all aspects of the structure solution, refinement and publication process and presents them in a single workflow-driven package, with the ultimate goal of producing an application which will be useful to both chemists and crystallographers.
Publisher
International Union of Crystallography (IUCr)
Subject
General Biochemistry, Genetics and Molecular Biology
Cited by
21914 articles.
订阅此论文施引文献
订阅此论文施引文献,注册后可以免费订阅5篇论文的施引文献,订阅后可以查看论文全部施引文献
1. A novel pyrazole derivative as COVID-19 main protease inhibitor: Synthesis, quantum computational studies, pharmacokinetic properties, drug likeness, molecular docking and dynamics simulation; a CADD approach;Chemical Physics Impact;2024-06
2. Multicomponent synthesis, structural and molecular dynamics simulation studies of a novel spirooxindole derivative;Chemical Physics Impact;2024-06
3. Hydantoin-D,L-valine: Synthesis, characterization, and non-covalent interaction analysis from crystallographic studies, DFTB calculations, and Hirshfeld surface analysis;Journal of Molecular Structure;2024-05
4. Structural, morphological, and modeling studies of N-(benzoyloxy)benzamide as a specific inhibitor of Type II inosine monophosphate dehydrogenase;Journal of Molecular Structure;2024-05
5. Two Zn(II)/Cd(II) coordination polymers based on 5-(3,5-dicarboxybenzyloxy)isophthalic acid for selective detection 4-nitrophenol and fluazinam in aqueous medium;Journal of Molecular Structure;2024-05