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.doctrees/develop/class/class_avogadro_1_1_core_1_1_slater_set.doctree
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(v1)= | ||
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# Avogadro 1 | ||
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Avogadro was designed to be a cross-platform molecular editor and visualization tool. In particular, it was built on top of the [Open Babel](https://openbabel.org) open source cheminformatics toolkit to handle import and export, force field optimization, partial charge assignment and other tasks. | ||
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The development and features of Avogadro were covered in: | ||
[Hanwell, M.D., Curtis, D.E., Lonie, D.C. et al. Avogadro: an advanced semantic chemical editor, visualization, and analysis platform. J Cheminform 4, 17 (2012).](https://doi.org/10.1186/1758-2946-4-17) | ||
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```{toctree} | ||
--- | ||
maxdepth: 1 | ||
--- | ||
v120 | ||
v111 | ||
v110 | ||
v103 | ||
v102 | ||
v101 | ||
v100 | ||
v099 | ||
v098 | ||
v097 | ||
v096 | ||
v095 | ||
v094 | ||
v093 | ||
v092 | ||
v091 | ||
v090 | ||
v081 | ||
v080 | ||
v061 | ||
v060 | ||
v020 | ||
v010 | ||
``` |
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(v2)= | ||
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# Avogadro v2 | ||
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Avogadro 2 is currently in beta. It was re-written from scratch to address a number of issues with the [Avogadro v1](v1) codebase. | ||
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Major concerns in Avogadro 1.0 focused on stability (i.e., crashes) and speed, particularly with molecules or systems over a few hundred atoms. **Avogadro v2 was designed for fast modern rendering and improved stability. It is a platform to make it easy to build the next generation of molecular and materials visualization and editing tools.** | ||
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```{toctree} | ||
--- | ||
maxdepth: 1 | ||
--- | ||
v199 | ||
v1981 | ||
v198 | ||
v197 | ||
v196 | ||
v1951 | ||
v195 | ||
v194 | ||
v193 | ||
v192 | ||
v191 | ||
v190 | ||
``` |
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@@ -7,7 +7,7 @@ previous versions of Avogadro (1.2 and older) | |
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```{toctree} | ||
--- | ||
maxdepth: 1 | ||
maxdepth: 2 | ||
--- | ||
v199 | ||
v1981 | ||
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(v101)= | ||
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# Avogadro v1.0.1 | ||
# Avogadro 1.0.1 | ||
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Avogadro 1.0.1 was released on 28 April 2010. | ||
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(v102)= | ||
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# Avogadro v1.0.2 | ||
# Avogadro 1.0.2 | ||
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Avogadro 1.0.2 was released on 22 April 2011. | ||
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(v110)= | ||
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# Avogadro v1.1.0 | ||
# Avogadro 1.1.0 | ||
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Avogadro 1.1.0 was released on September 12, 2012. | ||
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(v111)= | ||
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# Avogadro v1.1.1 | ||
# Avogadro 1.1.1 | ||
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Avogadro 1.1.1 was released on December 11, 2013. | ||
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(v190)= | ||
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# Avogadro 1.90.0 | ||
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3 December 2016 | ||
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We are pleased to announce the latest release of Avogadro, including piles of | ||
bug fixes and feature enhancements. | ||
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In particular v1.90 includes substantial improvements for handling crystallographic unit cells, including space group symmetry, and handling VASP calculations, as a result of a Google Summer of Code project of Patrick Avery. |
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(v191)= | ||
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# Avogadro 1.91.0 | ||
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22 August 2018 | ||
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We are pleased to announce the latest release of Avogadro, including piles of | ||
bug fixes and feature enhancements. | ||
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This release has a lot of new work completed over the last year, including the results of our first Google Summer of Code where two students worked on projects under the program. |
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(v192)= | ||
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# Avogadro 1.92.0 | ||
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31 October 2018 | ||
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We are pleased to announce the latest release of Avogadro, including piles of | ||
bug fixes and feature enhancements. | ||
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- Added support for the MMTF format form use with the Protein Data Bank | ||
- Added support for rendering atom forces | ||
- Added setting bond orders for common amino acid residues | ||
- New implementation of Python library using the Avogadro core for file IO and calculating orbitals and electron density |
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(v193)= | ||
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# Avogadro 1.93.0 | ||
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5 February 2020 | ||
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We are pleased to announce the latest release of Avogadro, including piles of | ||
bug fixes and feature enhancements. | ||
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- Support for Open Babel 3.0 | ||
- New rendering using VTK including volumetric orbitals and electron density | ||
- Use VTK charts for rendering band structures and other plots | ||
- Use MongoChem to access databases from servers |
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(v194)= | ||
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# Avogadro v1.94.0 | ||
# Avogadro 1.94.0 | ||
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2 June 2021 | ||
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(v195)= | ||
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# Avogadro v1.95.0 | ||
# Avogadro 1.95.0 | ||
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16 August 2021 | ||
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(v1951)= | ||
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# Avogadro v1.95.1 | ||
# Avogadro 1.95.1 | ||
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26 August 2021 | ||
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(v196)= | ||
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# Avogadro v1.96.0 | ||
# Avogadro 1.96.0 | ||
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2 June 2022 | ||
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(v197)= | ||
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# Avogadro v1.97.0 | ||
# Avogadro 1.97.0 | ||
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21 July 2022 | ||
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(v198)= | ||
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# Avogadro v1.98.0 | ||
# Avogadro 1.98.0 | ||
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26 October 2023 | ||
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(v1981)= | ||
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# Avogadro v1.98.1 | ||
# Avogadro 1.98.1 | ||
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2 November 2023 | ||
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(v199)= | ||
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# Avogadro v1.99.0 | ||
# Avogadro 1.99.0 | ||
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10 February 2024 | ||
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