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CHRIS

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8 contributors

History: 265 commits

Robert Elder

updated quantity module to use category-based sampling where possible

e02ea72 8 months ago

color2_module
updated RST with the reference and new disclaimer information 12 months ago
color3_module
quantity module + qrf updates 11 months ago
color_module
implemented OPERA melting point prediction 12 months ago
data
updated quantity module to use category-based sampling where possible 8 months ago
efficiency_module
updated RST with the reference and new disclaimer information 12 months ago
exposure2_module
updated RST with the reference and new disclaimer information 12 months ago
exposure3_module
quantity module + qrf updates 11 months ago
exposure_module
implemented OPERA melting point prediction 12 months ago
mp
updating OPERA MP model trained in environment matching container 12 months ago
qrf
updated quantity module to use category-based sampling where possible 8 months ago
quantity_module
updated quantity module to use category-based sampling where possible 8 months ago
static
storing js scripts locally for speed; removing reference to malware site polyfill.io about 1 year ago
templates
Removed MDDT version from tool 12 months ago
.gitattributes

211 Bytes
initial upload about 4 years ago
.gitignore

151 Bytes
quantity module + qrf updates 11 months ago
CHRIS.py

798 Bytes
Merge remote-tracking branch 'origin/master' 12 months ago
ChemID.py

49 kB
ChemID update: check for valid smiles before doing other work. quantity module updates: added effect of swelling on solvent volume; added check for non-physical amount of swelling; updated error templates to be more informative 11 months ago
functions.py

6.56 kB
updates to quantity module 12 months ago
polymer_names.tsv

3.72 kB
xet

removed degradables (PLA, PLGA, PCL) almost 3 years ago
polymers.py

4.08 kB
95th percentile bounds, correction to exposure2 COU almost 3 years ago