- Jul 23, 2019
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Anjana Elapavalore authored
* R/mix.R(presc.shiny): Added observeEvent, new server bits to plot pdf.
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Anjana Elapavalore authored
* R/mix.R: Modified server to test for button clicks.
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- Jul 22, 2019
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Todor Kondic authored
Master See merge request !1
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Todor Kondic authored
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Todor Kondic authored
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Todor Kondic authored
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Todor Kondic authored
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Jessy Krier authored
* R/mix.R(presc.shiny): Updated.
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- Jul 18, 2019
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Jessy Krier authored
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- Jul 11, 2019
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Todor Kondic authored
Layout plot See merge request rmb-mix-method!14
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- Jul 03, 2019
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Todor Kondic authored
Dev See merge request rmb-mix-method!12
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Todor Kondic authored
* DESCRIPTION: New imports. [curl] * R/mix.R(rendersmiles2,renderurl): New functions. Various function that are a rip-off of Emma's RChemMass and deal with the plotting of structures using an online resource. * man: Update docs.
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- Jul 02, 2019
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Todor Kondic authored
Numerous prettifying changes See merge request rmb-mix-method!11
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Todor Kondic authored
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- Jul 01, 2019
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Todor Kondic authored
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Todor Kondic authored
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Todor Kondic authored
More sensible (re)loading of the configuration files, encapsulation of certain operations and other fixes * mix.R(get_.*): Generate various filenames. * mix.R(various intermediate wrappers around RMassBank calls): removed. * run.R(presc.do): Adjust to changes in mix.R * man: Update docs. * NAMESPACE: Update exports.
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- Jun 28, 2019
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Todor Kondic authored
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Todor Kondic authored
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- Jun 26, 2019
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Todor Kondic authored
Rmbmix stable See merge request rmb-mix-method!8
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Todor Kondic authored
* README.org: New file.
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- Jun 25, 2019
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Todor Kondic authored
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Todor Kondic authored
The main issue is that I have removed type='FORK' everywhere it clearly produced issues. I should probably do that in presc, too.
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Todor Kondic authored
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Todor Kondic authored
Merge prescreening capability See merge request rmb-mix-method!7
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Todor Kondic authored
* README.org: New file.
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Todor Kondic authored
# Conflicts: # DESCRIPTION # R/mix.R
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Todor Kondic authored
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Todor Kondic authored
Finally plotting works nicely.
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- Jun 24, 2019
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Todor Kondic authored
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Todor Kondic authored
* R/mix.R(presc.plot): New argument. [pal] Colorbrewer palette.
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Todor Kondic authored
* R/mix.R(presc.plot): New function. Plots the prescreening data.
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Todor Kondic authored
R/mix.R(RMB_EIC_prescreen_df): Fix. Data frame now collects all children.
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Todor Kondic authored
* R/run.R(presc.do): New function. Top level prescreening function. * NAMESPACE: New exports. * man: Update doc.
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- Jun 23, 2019
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Todor Kondic authored
* R/mix.R(presc.p): New function. Paralellises presc.single. * NAMESPACE: New export. * man: Update docs.
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Todor Kondic authored
* R/mix.R(presc.v): New function. Vectorises presc.single. * NAMESPACE: Update exports. * man(presc.single.Rd,presc.v.Rd): Update docs.
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Todor Kondic authored
* R/mix.R(RMB_EIC_prescreen_df): New function. Instead of pdf file with plots, this one records the data.frames to laters serve as inputs to plotting stages.
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Todor Kondic authored
* R/mix.R(presc.single): Now loads the component list properly.
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- Jun 22, 2019
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Todor Kondic authored
This reverts commit a36f514a. The said commit was unnecessary.
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