A collection of PyMOL plugins to visualize atomic bonds.
☆22Sep 2, 2020Updated 5 years ago
Alternatives and similar repositories for BondPack
Users that are interested in BondPack are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- A parallel molecular docking program based on AutoDock Vina☆19Sep 29, 2025Updated 9 months ago
- An MPI based parallel implementation of Autodock Vina☆17Apr 3, 2020Updated 6 years ago
- Scripts used for virtual screening of small molecule inhibitors from ZINC database using Autodock Vina☆17Aug 25, 2014Updated 11 years ago
- the simple alchemistry test set☆10Nov 20, 2025Updated 8 months ago
- A package for MD, Docking and Machine learning drug discovery pipeline☆47Aug 30, 2020Updated 5 years ago
- 1-Click AI Models by DigitalOcean Gradient • AdDeploy popular AI models on DigitalOcean Gradient GPU virtual machines with just a single click. Zero configuration with optimized deployments.
- MMTSB Tool Set☆33Jan 26, 2026Updated 5 months ago
- Tutorials and examples for nicer animations (movies) and images in PyMOL.☆21Jan 29, 2015Updated 11 years ago
- Simulation-Enabled Estimation of Kinetic Rates - Version 2☆35Dec 10, 2025Updated 7 months ago
- Houses deployable code for the SCORCH scoring function and docking pipeline from the related publication: https://doi.org/10.1016/j.jare.…☆18Nov 29, 2022Updated 3 years ago
- ☆20Jan 31, 2021Updated 5 years ago
- Printing text using protein structures☆14Aug 9, 2021Updated 4 years ago
- Some notes (cookbook) for pyMol. Protein Crystallography course.☆17Jun 19, 2021Updated 5 years ago
- Dock Multiple Ligands with AutoDock Vina with one Command☆11Jan 10, 2018Updated 8 years ago
- ☆14Sep 18, 2023Updated 2 years ago
- 1-Click AI Models by DigitalOcean Gradient • AdDeploy popular AI models on DigitalOcean Gradient GPU virtual machines with just a single click. Zero configuration with optimized deployments.
- Pymol ScrIpt COllection (PSICO)☆66Mar 13, 2026Updated 4 months ago
- Material for the 3rd i-CoMSE Workshop: Methods for Advanced Sampling☆43May 1, 2023Updated 3 years ago
- ☆11May 12, 2026Updated 2 months ago
- ☆13Jul 25, 2025Updated 11 months ago
- Winter Break Collaboratory DS Boot Camp during the academic year of 2017-2018☆14Feb 12, 2018Updated 8 years ago
- (Linux and macOS) AMDock: Assisted molecular docking with AutoDock4 and AutoDockVina☆75Aug 3, 2023Updated 2 years ago
- ☆12Apr 21, 2026Updated 3 months ago
- A repository providing jupyter notebooks and simulation inputs that accompany the mini course Hands-on tutorials: Advanced sampling metho…☆24Sep 26, 2024Updated last year
- Collected scripts for Pymol☆529Mar 1, 2026Updated 4 months ago
- GPU virtual machines on DigitalOcean Gradient AI • AdGet to production fast with high-performance AMD and NVIDIA GPUs you can spin up in seconds. The definition of operational simplicity.
- ☆43Apr 21, 2022Updated 4 years ago
- A python package for performing GROMACS simulation ensembles☆22Jul 12, 2026Updated last week
- ☆21Updated this week
- ☆50Jun 15, 2026Updated last month
- A docker image containing changes applied to the ETKDG conformer generator workflow, with example scripts.☆12Jun 15, 2019Updated 7 years ago
- Selection language for RDKit☆17Mar 20, 2026Updated 4 months ago
- ☆23May 5, 2023Updated 3 years ago
- A MolProbity-style visualization plugin for PyMOL☆16Jul 26, 2022Updated 3 years ago
- ☆18Jan 15, 2026Updated 6 months ago
- 1-Click AI Models by DigitalOcean Gradient • AdDeploy popular AI models on DigitalOcean Gradient GPU virtual machines with just a single click. Zero configuration with optimized deployments.
- ☆12Oct 14, 2023Updated 2 years ago
- This package will help you perform a multiple minumum Monte Carlo conformer search as described in Chang et al., 1989. It is built to be …☆36Apr 23, 2026Updated 2 months ago
- Schrödinger Sketcher☆37Updated this week
- Fast, parallelized implementation of Principal Component Analysis with constant memory consumption for large data sets.☆12Feb 18, 2022Updated 4 years ago
- ☆19Feb 27, 2026Updated 4 months ago
- ☆13Jul 11, 2017Updated 9 years ago
- KIF - Key Interactions Finder. A python package to identify the key molecular interactions that regulate any conformational change.☆35Jan 6, 2026Updated 6 months ago