pb3lab / ibm3202Links
Google Colab Tutorials for IBM3202
☆272Updated last year
Alternatives and similar repositories for ibm3202
Users that are interested in ibm3202 are comparing it to the libraries listed below
Sorting:
- Cloud-based molecular simulations for everyone☆459Updated last month
- Jupyter Dock is a set of Jupyter Notebooks for performing molecular docking protocols interactively, as well as visualizing, converting f…☆273Updated 2 years ago
- Official repo of the modular BioExcel version of HADDOCK☆211Updated last week
- gmx_MMPBSA is a new tool based on AMBER's MMPBSA.py aiming to perform end-state free energy calculations with GROMACS files.☆285Updated last month
- A set of tools for manipulating and doing calculations on wwPDB macromolecule structure files☆180Updated 6 years ago
- P2Rank: Protein-ligand binding site prediction from protein structure based on machine learning.☆366Updated 2 months ago
- Let LLM run your MDs.☆238Updated 2 months ago
- Application to assign secondary structure to proteins☆228Updated last week
- fpocket is a very fast open source protein pocket detection algorithm based on Voronoi tessellation. The platform is suited for the scien…☆419Updated last year
- Machine Learning in Drug Discovery Resources 2024☆244Updated 7 months ago
- Interface for AutoDock, molecule parameterization☆313Updated this week
- Notebooks and environment set up for IQB 2024 workshop - Python for Molecular Docking☆71Updated 11 months ago
- Protein-ligand structure prediction☆235Updated 4 months ago
- Predict multiple protein conformations using sequence clustering and AlphaFold2.☆167Updated 2 months ago
- C-library for calculating Solvent Accessible Surface Areas☆168Updated 3 weeks ago
- Educational materials for, and related to, UC Irvine's Drug Discovery Computing Techniques course (PharmSci 175/275), currently taught by…☆161Updated 8 months ago
- ☆58Updated 3 years ago
- Predict the binding affinity of protein-protein complexes from structural data☆158Updated 2 months ago
- ☆299Updated 2 weeks ago
- PDBFixer fixes problems in PDB files☆605Updated last month
- Collected scripts for Pymol☆502Updated 4 months ago
- Code for ColabDock paper☆149Updated 7 months ago
- A Python API for the RCSB Protein Data Bank (PDB)☆332Updated 6 months ago
- Interaction Fingerprints for protein-ligand complexes and more☆455Updated last week
- Protein-protein, protein-peptide and protein-DNA docking framework based on the GSO algorithm☆367Updated 2 months ago
- DockQ is a single continuous quality measure for Protein, Nucleic Acids and Small Molecule Docking Models☆345Updated last month
- Tutorials, cheat sheets, and other resources for computational methods for protein design.☆124Updated 2 years ago
- This repository includes the slides and the practicals for the course of Structural Bioinformatics of the MBB/QB degrees at the Universit…☆88Updated last week
- Set of Python scripts designed to be a dependency-free cross-platform swiss army knife for PDB files.☆26Updated 3 years ago
- ChatMol☆240Updated 3 weeks ago