gustavor101

Pinned Repositories

ConstraintFreeMLIP
This repository contains files related to the data generation, training, and evaluation for MLIP models without mechanical constraints
Language:Python00
pruebaclasefinal
Prueba final de la clase de git.
1 7 10
silc
Screen for InterLocked Chemistry
Language:Jupyter Notebook0 3 20
open-Qmin
Liquid crystal simulations in the Landau de Gennes framework
Language:C++0 0 00
PySAGES
Python Suite for Advanced General Ensemble Simulations
Language:Python0 0 00
PySAGES-examples
Repository that showcases examples of the use of PySAGES coupled to a number of MD engines
Language:Jupyter Notebook0 0 00
PySAGES
Python Suite for Advanced General Ensemble Simulations
Language:Python75 8 6727
PySAGES-examples
Repository that showcases examples of the use of PySAGES coupled to a number of MD engines
Language:Jupyter Notebook3 5 72

gustavor101's Repositories

gustavor101/open-Qmin
Liquid crystal simulations in the Landau de Gennes framework
Language:C++0 0 00
gustavor101/PySAGES
Python Suite for Advanced General Ensemble Simulations
Language:Python0 0 00
gustavor101/PySAGES-examples
Repository that showcases examples of the use of PySAGES coupled to a number of MD engines
Language:Jupyter Notebook0 0 00