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MolecularAI
/
aizynthfinder
A tool for retrosynthetic planning
https://molecularai.github.io/aizynthfinder/
MIT License
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134
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Acceleration on AiZynthFinder
#166
XYxiyang
opened
6 days ago
1
Confidence Score
#165
shreyasvinaya
closed
1 month ago
3
Error while using `route cost` scorer
#164
shreyasvinaya
closed
1 month ago
4
Numpy 2.0 and GUI
#163
vfscalfani
closed
2 months ago
1
Tarball Version Needs Update for Python 3.10+
#162
balakrishnaboligerla2022
opened
2 months ago
1
Could not download stock files by "download_public_data"
#161
fumitoxinn
closed
3 months ago
0
Confusion regarding output and options
#160
Muzatheking12
opened
3 months ago
5
zsh: illegal hardware instruction aizynthcli
#159
McPeball
opened
4 months ago
1
Remove support to download public .hdf5 model files
#158
Lakshidaa
closed
4 months ago
0
Regarding with the error from performing download_public_data my_folder
#157
kingljy0818
opened
4 months ago
4
Release 4.3.0
#156
Lakshidaa
closed
4 months ago
0
Release candidate 3.6.0 running on python 3.11.
#155
proddi
closed
5 months ago
0
regarding functional groups or protecting groups added with more reasonable or supervisable way
#154
yangxiaofei77
closed
4 months ago
2
aizynthfinder process is killed after loading config.yml
#153
ZHZihangHuang
closed
4 months ago
3
regarding ringbreaker template, neither _apply_with_rdchiral or _apply_with_rdkit return null reactants list
#152
yangxiaofei77
closed
5 months ago
3
Some Questions Regarding Expansion Strategies
#151
lz2021211161
closed
7 months ago
4
DEPRECATION problem when install the tool
#150
HeartedMoon
closed
7 months ago
0
PolicyException: A QuickKerasFilter class needs to be initiated with keyword arguments: model"
#149
MachineGUN001
closed
8 months ago
6
Bump aiohttp from 3.9.0 to 3.9.2
#148
dependabot[bot]
opened
8 months ago
1
Bump pillow from 9.5.0 to 10.2.0
#147
dependabot[bot]
opened
9 months ago
1
Bump jinja2 from 3.1.2 to 3.1.3
#146
dependabot[bot]
opened
9 months ago
1
ipywidgets version might need updating?
#145
MKCarter
opened
10 months ago
4
The request for grouping sibling nodes for retro* algorithm
#144
queliyong
opened
10 months ago
0
Bump jupyter-server from 2.10.1 to 2.11.2
#143
dependabot[bot]
opened
10 months ago
0
Bump pillow from 9.5.0 to 10.0.1
#142
dependabot[bot]
closed
9 months ago
1
Release 4.0.0
#141
Lakshidaa
closed
10 months ago
2
parsing the json output
#140
mmagithub
closed
10 months ago
2
Error displaying widget in Jupyter notebook
#139
Versallius
closed
10 months ago
8
different result using python interface with using third party website
#138
hongxianglics
closed
1 year ago
4
remove useless rollout_child
#137
bruceunx
closed
10 months ago
1
create stock: Failed to convert to inchi key. Probably due to sanitation.
#136
hongxianglics
closed
1 year ago
3
How to get raw dataset
#135
bruceunx
closed
1 year ago
2
not work
#134
hongxianglics
closed
1 year ago
1
Incorrect labels in USPTO templates data
#133
m-mokaya
closed
1 year ago
2
Bump tornado from 6.2 to 6.3.3
#132
dependabot[bot]
closed
10 months ago
1
Unable to open/create file hdf5 files
#131
MachineGUN001
closed
1 year ago
4
Cant download the models (automatically, through UI of figshare )
#130
nitesh-acog
closed
1 year ago
2
Bump certifi from 2022.12.7 to 2023.7.22
#129
dependabot[bot]
closed
10 months ago
2
Recurring Issue with Jupyter interface
#128
aa0929
closed
1 year ago
10
Bump aiohttp from 3.8.4 to 3.8.5
#127
dependabot[bot]
closed
10 months ago
2
UCB formula question
#126
willfinnigan
opened
1 year ago
1
A question regarding cleaning training data with rxnutils package
#125
yangxfei
closed
1 year ago
2
how to add stock molecules?
#124
hongxianglics
closed
1 year ago
2
A question regarding how to get template_hash column in trainning data?
#123
philipyang1
closed
1 year ago
2
A question regarding the modeling generalization ability
#122
philipyang1
closed
1 year ago
3
Can't Install aizynthfinder
#121
emmakodes
closed
1 year ago
3
Publish package distribution releases to PyPI
#120
Lakshidaa
closed
1 year ago
0
Bump tornado from 6.2 to 6.3.2
#119
dependabot[bot]
closed
1 year ago
2
Bump requests from 2.28.1 to 2.31.0
#118
dependabot[bot]
closed
10 months ago
2
Memory use accumulates when analysing numerous SMILES
#117
chubbant
closed
1 year ago
2
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