29 Commits (5984ed55667fa471dd79a6b4ef4af43f564c6c18)

 

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Author	SHA1	Message	Date
titusquah	5984ed5566	flipped backslashes for package files	5 years ago
titusquah	511472d2c4	removed 'r' when accessing package files	5 years ago
titusquah	18ba8dda20	updated zeroes_removed_PC88A_HCL_NdPrCeLaDySmY.csv to be labeled	5 years ago
titusquah	f4fbb11b8c	changed xml_path in iterative_fitter.py and added iterative_fitter_monitor.py	5 years ago
titusquah	cab58fda25	commented out skopt in optimizers	5 years ago
titusquah	159a5c8140	added example file to do iterative optimization	5 years ago
titusquah	ac8067baf4	fixed parity plot bug for unlabeled, uncolored data	5 years ago
Tquah	1facd9bb42	updated getting started file	5 years ago
titusquah	b67b1a6b08	fixed setup file by changing LLEPE to llepe	5 years ago
titusquah	adbfd57931	updated to LLEPE	5 years ago
titusquah	0a9a7ffddc	changed REEPS name to LLEPE, modified opt_dict to deal with more general xml properties,	5 years ago
titusquah	97ca231afc	Edited parity plot to allow color to represent 3rd dimension. Still need to improve colorbar axis name.	5 years ago
titusquah	77e4cefd2c	Included package data in data/csvs and data/xmls. Note this only works for sdists. If bdist is needed, research "manifest.in" python setup files.	5 years ago
titusquah	f07fb03b93	Added docs and generalized to multiple species	5 years ago
titusquah	a0e8bdb9fd	Added r-squared printout to parity plot. Fixed default optimizer to detect number of dimensions and update bounds to match.	5 years ago
titusquah	07d6a0ac3c	added docs	5 years ago
titusquah	a8fd716937	Allow user to change optimizer and objective function. Also added r-squared evaluator. Changed temp file location to user temp folder. Added a prediction dictionary to access the values predicted by model.	5 years ago
titusquah	bc568a485b	generalized optimization to modify different species and thermo properties	5 years ago
titusquah	2bb9b7c24a	Modified reeps to grab charge from REE in xml file for initial chlorine moles calculation	5 years ago
titusquah	52c8efc05e	Modified reeps to grab charge from REE in xml file for initial chlorine moles calculation	5 years ago
titusquah	5dd4d37c02	Completed one composition parameter estimation	5 years ago
titusquah	ff5cab12a7	started project	5 years ago
titusquah	7bfeaae683	commit 2	5 years ago
titusquah	2cf080bf3c	started project	5 years ago
titusquah	ae6aa4291a	started project	5 years ago
titusquah	3c0ccc6b30	added idea xml and iml files	5 years ago
titusquah	c29be6afc6	started project	5 years ago
titusquah	d7e9c6fab6	started project	5 years ago
Chukwunwike Iloeje	b6476b49d0	Initial commit	5 years ago