anthonialcaraz Goto Github PK

combinarcorrespondencia

Este proyecto permite realizar combinaciones de correspondencia avanzadas con Microsoft Word, donde el usuario puede elegir que se generen pdfs, que se firmen, que cada documento tenga un nombre específico y que se envíen por correo.

doccou

A file pages counter

geometric

Geometry optimization code that includes the TRIC coordinate system

grand

A Python module for carrying out GCMC insertions and deletions of water molecules in OpenMM.

md_methods-and-analysis

Repository for MD methods and analysis from submitted or published work

openmm-md

Lee-Ping's general purpose script for running OpenMM molecular dynamics simulations

openmm-ml

High level API for using machine learning models in OpenMM simulations

openmmexampleplugin

An example of how to write a plugin for OpenMM

pdbfixer

PDBFixer fixes problems in PDB files

pytim

a python package for the interfacial analysis of molecular simulations

saltswap

Package to fluctuate the number of counterions in an OpenMM simulation

talleropenmm