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1. GHS-codes-from-CAS-numbers GHS-codes-from-CAS-numbers Public

   This is a project that scrapes PubChem data for GHS hazard codes given CAS numbers

   Jupyter Notebook 2

2. ligand_docking_vina_analysis ligand_docking_vina_analysis Public

   Set of scripts used to automate ligand-protein docking analysis to create input files and read output files from autodock vina. There is also a script for cleaning amino acid text sequences for use…

   Jupyter Notebook 1 1

3. create_calendar_for_low_tides create_calendar_for_low_tides Public

   I wrote this code to build calendars for google calendar but it should also work on any platform that accepts the Microsoft outlook format for calendar.

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4. fasta_files_from_accession_codes fasta_files_from_accession_codes Public

   This script iterates over an excel file with Genbank accession numbers. It creates individual fasta files with customized deflines for every valid accession number. It also creates a combined fasta…

   Jupyter Notebook

5. che_chem_293 che_chem_293 Public

   Forked from J-81/che_chem_293