AdityaSavara

Aditya Savara's repositories

PEUQSE

Parameter estimation for complex physical problems often suffers from finding ‘solutions’ that are not physically realistic. The PEUQSE software provides tools for finding physically realistic parameter estimates, graphs of the parameter estimate positions within parameter space, and plots of the final simulation results.

Language:Python13 2 111

JDX_Converter

This program is the JDX file converter that is used to read NIST mass spec data into a CSV format.

Language:PythonNOASSERTION7 1 5

JSONGrapher

Language:JavaScriptNOASSERTION2 2 5

UnitTesterSG

UnitTesterSG is for unit testing scientific/engineering outputs. It accommodates nested and even staggered array type structures, and mixed data types (like strings and integers etc). It also enables you to set numerical and absolute tolerances. Compatible with pytest.

Language:Python2 1 5

kmcos

Kinetic Monte Carlo of Systems (KMCOS): lattice based kinetic Monte Carlo with a python front-end and Fortran back-end.

Language:FortranGPL-3.0100

catmap

Catalyst Micro-kinetic Analysis Package for automated creation of micro-kinetic models used in catalyst screening

Language:PythonGPL-3.0010

CiteSoft_Py

Language:PythonBSD-3-Clause03 3

CiteSoft_py_old

020

duecredit

Automated collection and reporting of citations for used software/methods/datasets

Language:PythonNOASSERTION010

flask-share

Create social share component in Jinja2 template based on share.js.

Language:PythonMIT010

Frhodo

Simulate experimental data and optimize chemical kinetics mechanisms with this GUI-based application

Language:PythonNOASSERTION010

MSRESOLVE

MSRESOLVESG. A program for converting mass spectrometry signals to concentrations. Baseline corrections, smoothing, solving overlapping patterns, mass spectrometer tuning, and more.

Language:Python01 33