SCRIPTS

Collection of scripts for different applications

List of scripts

• QC_AIMD_TO_XYZ : Converts Q-Chem AIMD jobs to XYZ trajectories.
• Gaussian_Spectrum : Plot spectrum from excitation energies of Q-Chem output.
• HuckelSolver : Solve Hückel problem for arbitrary molecules (xyz file input).
• Two_sum : Find integers in list that sums up to target number.
• Temperature_converter : Convert temperature from Celsius to Kelvin and Fahrenheit.
• Sort_by_height : Sort list of people in ascending order of their height.
• Roman_to_numerals : Convert Roman numbers to numerals.
• Parenthesis_check : Returns a bool depending if list of parenthesis are properly closed.
• Palindrom_number : Check if given number is a palindrome.
• min_row_max_column : Find number in matrix that is a minimum in its row and maximum in its column.
• Common_prefix : Find longest common prefix in list of strings.
• ML -> Health_Insurance_estimator : Linear regression model to estimate health insurance cost.
• ML -> Image_recognition : NN for image classification of clothes.