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ssiddhantsharma / Molecular_Representations.ipynb
Created October 21, 2021 19:26
Simple conversion of a SMILES String to 3 different chemical data formats. See Figure 1. https://iopscience.iop.org/article/10.1088/2632-2153/aba947/meta
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ssiddhantsharma / methods.sh
Created August 5, 2020 21:12
Various methods to generate csv from files <3
View methods.sh
---------------------------------------------------TEAM-CURIE------------------------------------------------------------
!/bin/bash
actual_dir=$PWD
git clone https://github.com/Jairohc/team-curie.git
cd team-curie
cd submission_scripts
#BASH
bash 1_bash.sh > bash_tmp
bash 1_bash_tiffany.sh > bash_2_tmp
#ruby