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Name: Matteo
Type: User
Company: University of Cologne
Bio: Chemist, pursuing an MS in Chemistry. I just use Python to get my work done pretty fast!
Location: Cologne
Blog: matteopaolieri.it
Matteo's Projects
appunti
Alcuni comandi utili in continuo aggiornamento che mi sono appuntato durante il mio apprendimento di linux, bash shell, python, scripting e cose varie.
blacomcalc
A simple Computational Chemistry script written in Python to calculate bond lengths, BLA value (Bond Length Alternation), center of masses (CoM), distances between center of masses and bond angles of the given molecules and bonds, starting from a standard .xyz geometry file.
fortran-non-linear-equation
Non-linear equations solver made in Fortran. It uses both Newton and bisection methods.
gnuplot-langelier-ludwig-diagram
Generate a Langelier-Ludwig using GNUPLOT
latex-table-csv
LaTex table generator in bash, starting from a .csv file.
pymergecolumns
A Python script to merge plain text formatted data column by column sequentially into one file.
pymol-cookbook
Some notes (cookbook) for pyMol. Protein Crystallography course.
pynormalizeplot
Quick script to normalize data of one plot, e.g. spectra.
topspin-to-csv
A very simple Python script to generate a normal X/Y csv file from a Bruker TopSpin® .txt file
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