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Modeling framework for eTRANSAFE project
GNU General Public License v3.0
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Imbalance numpy
#187
josecarlosgomezt
closed
4 years ago
0
Imbalance performed with numpy and fixed bug at checking incremental …
#186
josecarlosgomezt
closed
4 years ago
1
CV of conformal models
#185
manuelpastor
closed
4 years ago
2
Logger fails in ensemble models
#184
manuelpastor
closed
4 years ago
1
New backend api
#183
manuelpastor
closed
4 years ago
1
External_licenses.md: RDKit has 3-clause BSD licence
#182
ismaelresp
closed
4 years ago
0
Update README.md
#181
josecarlosgomezt
closed
4 years ago
0
chEMBL standardize method implemented
#180
josecarlosgomezt
closed
4 years ago
1
Added interpretation file to documentation.
#179
josecarlosgomezt
closed
4 years ago
1
Molecular drawer
#178
josecarlosgomezt
opened
4 years ago
1
Some code quality improvement
#177
josecarlosgomezt
closed
1 year ago
1
Bug fixed
#176
josecarlosgomezt
closed
4 years ago
0
# XGboost bugs fixed
#175
josecarlosgomezt
closed
4 years ago
1
Data scaling on ensemble models control
#174
josecarlosgomezt
closed
4 years ago
1
Ensemble models data harmonization bug.
#173
josecarlosgomezt
closed
4 years ago
1
Scaling not performed over morgan FP at model building resulting in error at prediction
#172
josecarlosgomezt
closed
4 years ago
1
Ensemble predictions
#171
IgnacioPasamontes
closed
4 years ago
1
xgboost now installed with pip (to unresolved package dependency in w…
#170
josecarlosgomezt
closed
4 years ago
0
Persistent predict
#169
manuelpastor
closed
4 years ago
1
Xgboost implementation
#168
josecarlosgomezt
closed
4 years ago
1
errors importing syntactically uncorrect SDFiles
#167
manuelpastor
closed
4 years ago
2
errors importing SDFile with non-UTF8 molecule names
#166
manuelpastor
closed
4 years ago
1
mordred descriptors removed temporary
#165
josecarlosgomezt
closed
4 years ago
0
mordred descriptors not computed
#164
manuelpastor
closed
4 years ago
1
Update environment.yml
#163
IgnacioPasamontes
closed
4 years ago
0
Mordred
#162
josecarlosgomezt
closed
4 years ago
0
mordred implementation. Alpha stutus
#161
josecarlosgomezt
closed
4 years ago
1
Check parameters in similarity search
#160
IgnacioPasamontes
closed
4 years ago
1
New documentation output in YAML format implemented.
#159
josecarlosgomezt
closed
4 years ago
1
Build command not working if no parameter file is given as argument
#158
josecarlosgomezt
closed
5 years ago
1
Travis status for branches not working
#157
josecarlosgomezt
closed
4 years ago
1
Document 2
#156
josecarlosgomezt
closed
5 years ago
1
Build_cmd param_file and param_string
#155
IgnacioPasamontes
closed
5 years ago
1
- Parameter value access changed.
#154
josecarlosgomezt
closed
5 years ago
1
documentation.py must use new parameters class
#153
manuelpastor
closed
5 years ago
1
PLSR errors with some data scaling combinations
#152
manuelpastor
closed
5 years ago
2
Check ENDPOINT before search
#151
IgnacioPasamontes
closed
4 years ago
1
action_new return path instead of name space
#150
IgnacioPasamontes
closed
5 years ago
1
smanage spaces directories
#149
kpinto-gil
opened
5 years ago
0
Euclidean distance
#148
kpinto-gil
closed
5 years ago
1
Check ENDPOINT before get parameters of a model version
#147
IgnacioPasamontes
closed
4 years ago
1
Space
#146
manuelpastor
closed
5 years ago
1
Error when computing 3Dcoordinates with RDKit
#145
kpinto-gil
opened
5 years ago
0
Check ENDPOINT before build
#144
IgnacioPasamontes
closed
5 years ago
2
Check ENDPOINT before predict
#143
IgnacioPasamontes
closed
5 years ago
1
TSV output skipping last prediction
#142
josecarlosgomezt
closed
4 years ago
1
Control the version of libraries
#141
IgnacioPasamontes
closed
3 years ago
1
delete _ex string from prediction results
#140
IgnacioPasamontes
closed
5 years ago
1
issue with pip when creating flame env
#139
nbosc
closed
4 years ago
3
Small problems with machine learner parameters using the GUI
#138
manuelpastor
closed
1 year ago
1
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