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daenuprobst
/
molzip
The gzip classification method implemented for molecule classification.
MIT License
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Issue with descriptastorus
#21
janweinreich
opened
10 months ago
0
reminder: redefine distance to be symmetric
#20
janweinreich
closed
10 months ago
1
added gzip PCA
#19
janweinreich
closed
1 year ago
0
Data conversion in main.py
#18
janweinreich
closed
1 year ago
3
Added a new QMOF dataset
#17
RishikeshMagar
closed
1 year ago
0
Added a new dataset
#16
RishikeshMagar
closed
1 year ago
0
Robustness to SMILES Permutations
#15
JanoschMenke
opened
1 year ago
2
Relationship between compression and Lee Cronin's "Assembly Theory"
#14
jschrier
closed
1 year ago
3
Models
#13
EricBoittier
opened
1 year ago
2
Would like to contribute to the project
#12
RishikeshMagar
opened
1 year ago
2
TODO (For ME)
#11
PowersPope
opened
1 year ago
3
TODO (for me :) )
#10
janweinreich
opened
1 year ago
7
added hyperparameter opt for KRR
#9
janweinreich
closed
1 year ago
1
Getting Involved and Commenting
#8
PowersPope
opened
1 year ago
3
added kernel ridge regression
#7
janweinreich
closed
1 year ago
2
I like to collaborate
#6
MoSuunny
opened
1 year ago
2
Paper writing collaboration
#5
DavidLandup0
opened
1 year ago
2
Add colab
#4
driesvr
closed
1 year ago
1
Colab notebook
#3
driesvr
opened
1 year ago
1
Extend this to proteins and/or small mol docking?
#2
tanmoy7989
opened
1 year ago
1
Why not try regression too?
#1
janweinreich
closed
1 year ago
2