Build hydrogen atoms from united-atom molecular dynamics of lipids and calculate the order parameters.
☆15Dec 20, 2022Updated 3 years ago
Alternatives and similar repositories for buildH
Users that are interested in buildH are comparing it to the libraries listed below
Sorting:
- Computational materials design, with less code.☆13Feb 19, 2026Updated last week
- Sample molecular simulation workflows using a MoSDeF and community tools☆16Jul 19, 2022Updated 3 years ago
- NanoOpt: Deriving potentials for coarse-grained nanoparticles via potential-matching☆10Oct 8, 2021Updated 4 years ago
- ChemoPy: freely available python package for computational biology and chemoinformatics.☆13May 30, 2021Updated 4 years ago
- Command line tool providing BOSS generated OPLS-AA/CM1A(-LBCC) parameters for organic molecules and ligands.☆11Oct 5, 2017Updated 8 years ago
- ☆18Dec 2, 2024Updated last year
- Flexible Library of Organic Workflows and Extensible Recipes for Molecular Dynamics.☆22Updated this week
- Parallel programming with Python exercises☆13Feb 18, 2025Updated last year
- Rapidly visualize signac projects through a customizable dashboard interface.☆16Feb 19, 2026Updated last week
- Polarisable force field for ionic liquids☆16Feb 11, 2026Updated 2 weeks ago
- Repository for Chemical Perception Sampling Tools☆21Aug 13, 2024Updated last year
- AqSolDB: A curated aqueous solubility dataset contains 9.982 unique compounds.☆29Apr 18, 2020Updated 5 years ago
- Next-generation sequencing analysis pipelines & scrips☆10Nov 25, 2020Updated 5 years ago
- To analyze fluctuations in DNA or RNA structures in molecular dynamics trajectories.☆27Apr 15, 2025Updated 10 months ago
- A suite of tools to explore protein structures with Protein Blocks☆29Jan 27, 2021Updated 5 years ago
- Massively parallel hybrid particle-field molecular dynamics in Python.☆30Sep 6, 2024Updated last year
- The core part of Atomic Charge Calculator III.☆29Dec 14, 2025Updated 2 months ago
- Density based object completion over PBC.☆30Dec 10, 2024Updated last year
- A python toolkit for analysing membrane protein-lipid interactions.