published Published almost 2 years ago
Chitin Builder: a VMD tool for the generation of structures of chitin molecular crystals for atomistic simulations
Tcl Rich Text Format
@jfaraudo
published Published almost 2 years ago
FlowerMD: Flexible Library of Organic Workflows and Extensible Recipes for Molecular Dynamics
Python Jupyter Notebook
@marjanalbouye
published Published about 2 years ago
QMCTorch: a PyTorch Implementation of Real-Space Quantum Monte Carlo Simulations of Molecular Systems
Python
@NicoRenaud
published Published over 2 years ago
MembraneAnalysis.jl: A Julia package for analyzing molecular dynamics simulations of lipid membranes
Julia
@amiralih
@orionarcher
published Published almost 3 years ago
oxDNA: coarse-grained simulations of nucleic acids made simple
Python C Cython
@lorenzo-rovigatti
published Published about 3 years ago
Xponge: A Python package to perform pre- and post-processing of molecular simulations
Python
@Xia-Yijie
published Published almost 4 years ago
physical_validation: A Python package to assess the physical validity of molecular simulation results
Python
@ptmerz
published Published about 4 years ago
buildH: Build hydrogen atoms from united-atom molecular dynamics of lipids and calculate the order parameters
Python
@patrickfuchs
published Published almost 5 years ago
@symmy596
