Lorenzo Tinacci's repositories
Isomers_generator
Python code for generating all the possible molecules starting from a chemical formula
Connectivity_chemical_graph
Python script that permits to encode molecules as molecular graph and compare easily the connectivity of two molecules
FortranThermoStats
Molecule thermostatistics properties code in Fortran90
LorenzAttractor
Lorenz Attractor simulation code in C
BE_prefactor
TPD and prefactor BE functions and library
FromGraphToXYZ
Script to help in the creation of molecules xyz file from molecular graph (i.e. only connectivity).
GreToBaPe_Cleaning
Cleaning Astrochemical Reaction network via Thermodynamics principles
Jmol_BE_CH3OH_visualization
HTML webpage with the Jmol applet in order to display all the methanol BEs on icy grain. To see it go to: https://tinaccil.github.io/Jmol_BE_CH3OH_visualization/
Jmol_BE_H2O_visualization
HTML webpage with the Jmol applet in order to display all the water BEs on icy grain. To see it go to: https://tinaccil.github.io/Jmol_BE_H2O_visualization/
Jmol_BE_NH3_visualization
HTML webpage with the Jmol applet in order to display all the ammonia BEs on icy grain. To see it go to: https://tinaccil.github.io/Jmol_BE_NH3_visualization/
Jmol_BE_prefactor_visualization
HTML webpage with the Jmol applet in order to display all the samples. To see it go to: https://tinaccil.github.io/Jmol_BE_prefactor_visualization/
Jmol_cation_visualization
HTML webpage with the Jmol applet in order to display all the ISM cations. To see it go to: https://tinaccil.github.io/Jmol_cation_visualization/
QueryAstroWoonDatabase
Query Woon-Herbst moleculues-properties database
QueryKIDAdatabase
This is a program to query and extract all the species info, inside KIDA database.