christofid commited on
Commit
4d3b03e
1 Parent(s): a03d1c3

Update requirements.txt

Browse files
Files changed (1) hide show
  1. requirements.txt +15 -2
requirements.txt CHANGED
@@ -6,11 +6,24 @@ torch==1.12.1
6
  torch-scatter
7
  torch-spline-conv
8
  torch-sparse
 
9
  torchvision==0.13.1
10
  torchaudio==0.12.1
11
  gt4sd>=1.1.10
 
 
 
 
12
  gradio==3.12.0
13
  markdown-it-py>=2.1.0
14
  numpy==1.23.5
15
- nglview==3.0.3
16
- pandas>=1.0.0
 
 
 
 
 
 
 
 
 
6
  torch-scatter
7
  torch-spline-conv
8
  torch-sparse
9
+ torch-geometric
10
  torchvision==0.13.1
11
  torchaudio==0.12.1
12
  gt4sd>=1.1.10
13
+ diffusers==0.6.0
14
+ molgx>=0.22.0a1
15
+ molecule_generation
16
+ PyTDC==0.3.7
17
  gradio==3.12.0
18
  markdown-it-py>=2.1.0
19
  numpy==1.23.5
20
+ pandas>=1.0.0
21
+ terminator @ git+https://github.com/IBM/regression-transformer@gt4sd
22
+ guacamol_baselines @ git+https://github.com/GT4SD/guacamol_baselines.git@v0.0.2
23
+ moses @ git+https://github.com/GT4SD/moses.git@v0.1.0
24
+ paccmann_chemistry @ git+https://github.com/PaccMann/paccmann_chemistry@0.0.4
25
+ paccmann_generator @ git+https://github.com/PaccMann/paccmann_generator@0.0.2
26
+ paccmann_gp @ git+https://github.com/PaccMann/paccmann_gp@0.1.1
27
+ paccmann_omics @ git+https://github.com/PaccMann/paccmann_omics@0.0.1.1
28
+ paccmann_predictor @ git+https://github.com/PaccMann/paccmann_predictor@sarscov2
29
+ reinvent_models @ git+https://github.com/GT4SD/reinvent_models@v0.0.1