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Is life worth living?
iwatobipen.wordpress.com
Is life worth living?
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1w
1 week ago
Useful package for enumerating reaction prodcuts from building block dataset #cheminformatics #rdkit #memo
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Actions for Useful package for enumerating reaction prodcuts from building block dataset #cheminformatics #rdkit #memo
Is life worth living?
·
3w
3 weeks ago
Rational Design of Degrader with AI and MS technology #memo #journal
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Actions for Rational Design of Degrader with AI and MS technology #memo #journal
Is life worth living?
·
6w
6 weeks ago
Integration QM and RDKit #cheminformatics #orca
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Actions for Integration QM and RDKit #cheminformatics #orca
Is life worth living?
·
7w
7 weeks ago
Tool for automated protein-ligand binding site extraction #cheminformatics #Journal #memo
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Actions for Tool for automated protein-ligand binding site extraction #cheminformatics #Journal #memo
Is life worth living?
·
10w
10 weeks ago
ESI descriptors for scaffold hopping #memo #journal #LBDD #cheminformatics
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Actions for ESI descriptors for scaffold hopping #memo #journal #LBDD #cheminformatics
Is life worth living?
·
11w
11 weeks ago
Use transformer model for Lead optimization #journal #memo
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Actions for Use transformer model for Lead optimization #journal #memo
Is life worth living?
·
15w
15 weeks ago
Change heterocycle to another isoster with HCIE #memo #cheminformatics #RDKit
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Actions for Change heterocycle to another isoster with HCIE #memo #cheminformatics #RDKit
Is life worth living?
·
15w
15 weeks ago
Rendering molecular image on Dataframe and Plot with marimo #Memo #RDKit #Cheminformatics
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Actions for Rendering molecular image on Dataframe and Plot with marimo #Memo #RDKit #Cheminformatics
Is life worth living?
·
19w
19 weeks ago
Split PROTAC molecule to 3 compornents with protac_splitter #RDKit #cheminfomratics #memo #python
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Actions for Split PROTAC molecule to 3 compornents with protac_splitter #RDKit #cheminfomratics #memo #python
Is life worth living?
·
21w
21 weeks ago
New clustering algorithm for cheminformatics #bblean #cheminformatics #RDKit
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Actions for New clustering algorithm for cheminformatics #bblean #cheminformatics #RDKit
Is life worth living?
·
23w
23 weeks ago
Useful utils for analysing chemical reaction #cheminformatics #rdkit #rxnutils
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Actions for Useful utils for analysing chemical reaction #cheminformatics #rdkit #rxnutils
Is life worth living?
·
24w
24 weeks ago
Look Back at 2025 #diary
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Actions for Look Back at 2025 #diary
Is life worth living?
·
24w
24 weeks ago
Considering predictive models for using cheminfomratics tasks #cheminfomratics #memo #journal
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Actions for Considering predictive models for using cheminfomratics tasks #cheminfomratics #memo #journal
Is life worth living?
·
27w
27 weeks ago
Use joblib with free-threaded python #memo #diary
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Actions for Use joblib with free-threaded python #memo #diary
Is life worth living?
·
30w
30 weeks ago
Similarity screening with RDKit #RDKit #SimilarityScreener #memo #cheminformatics
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Actions for Similarity screening with RDKit #RDKit #SimilarityScreener #memo #cheminformatics
Is life worth living?
·
32w
32 weeks ago
Install roshambo2 to pixi env #memo #cheminformatics #RDKit
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Actions for Install roshambo2 to pixi env #memo #cheminformatics #RDKit
Is life worth living?
·
33w
33 weeks ago
Run MD simulation with Openff&Openmm on pixi’s env #cheminformatics #RDKit #pixi #memo
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Actions for Run MD simulation with Openff&Openmm on pixi’s env #cheminformatics #RDKit #pixi #memo
Is life worth living?
·
33w
33 weeks ago
Build environment from github repository with pixi #cheminformatics #memo #pixi
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Actions for Build environment from github repository with pixi #cheminformatics #memo #pixi
Is life worth living?
·
36w
36 weeks ago
Try to use new package manager for python #pixi #memo
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Actions for Try to use new package manager for python #pixi #memo
Is life worth living?
·
38w
38 weeks ago
GPU based fast Shape alignment of molecules #RDKit #Roshambo2 #Cheminformatics
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Actions for GPU based fast Shape alignment of molecules #RDKit #Roshambo2 #Cheminformatics
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