☆26Feb 11, 2026Updated 2 weeks ago
Alternatives and similar repositories for boltztools
Users that are interested in boltztools are comparing it to the libraries listed below
Sorting:
- 这里提供了一个yaml可以通过conda来快速无痛一键安装ESMfold，算是已经踩过所有通过官方安装遇到的暗坑了。☆16Jan 31, 2024Updated 2 years ago
- ParametrizANI - Fast, Accurate and Free Dihedral Parametrization in the Cloud with TorchANI☆22Jul 28, 2025Updated 7 months ago
- ☆65Jun 27, 2025Updated 8 months ago
- A package to create, visualize, and analysis PDB-derived pseudo-ensembles.☆10Jan 7, 2026Updated last month
- PairMap: An Intermediate Insertion Approach for Improving the Accuracy of Relative Free Energy Perturbation Calculations for Distant Comp…☆16Oct 23, 2025Updated 4 months ago
- Coarse-grained and Multi-dimensional Data-driven molecular generation (CMD-GEN). This framework bridges three-dimensional ligand-protein …☆16Sep 13, 2025Updated 5 months ago
- GatorAffinity: Boosting Protein-Ligand Binding Affinity Prediction with Large-Scale Synthetic Structural Data☆26Dec 5, 2025Updated 2 months ago
- Contributed and additional nodes for maize☆21Feb 18, 2026Updated last week
- ☆12Oct 12, 2023Updated 2 years ago
- code for IDR binding paper 2025☆68Feb 15, 2025Updated last year
- material for cheminfo tutorial☆13Oct 26, 2023Updated 2 years ago
- ☆21Jan 1, 2026Updated last month
- This repository contains reference data from the Richardson Lab at Duke.☆15Jul 26, 2023Updated 2 years ago
- download and prepare a pdb file for docking wth Vina-flavoured algorithms☆13Oct 11, 2021Updated 4 years ago
- Dashboard for LLM Drug Discovery Challenge.☆14Sep 6, 2023Updated 2 years ago
- Accessing AlphaMissense Data Resources in R☆13Nov 26, 2025Updated 3 months ago
- A structured 15-week ML roadmap with theory, coding, and real-world projects. Developed by BioMindAI Lab @ CUNY.☆20Aug 12, 2025Updated 6 months ago
- Enables using Boltz-1/1x to predict the structure of arbitrary covalent modifications / Non-Canonical Amino Acids. Covalent bonds are enf…☆20May 21, 2025Updated 9 months ago
- A scalable machine learning pipeline for probe specificity prediction.☆14Jan 23, 2024Updated 2 years ago
- ☆15Sep 21, 2022Updated 3 years ago
- MBP: Multi-task Bioassay Pre-training for Protein-Ligand Binding Affinity Prediction☆21Oct 15, 2024Updated last year
- EnzyMM - Enzyme Motif Miner - Geometric matching of catalytic motifs in protein structures.☆35Feb 19, 2026Updated last week
- dictionary of monomers and links☆19Feb 11, 2026Updated 2 weeks ago
- A Streamlit wrapper component on react-smooth-dnd☆22Feb 15, 2024Updated 2 years ago
- Scroll-based navigation for seamless single-page applications.☆18Nov 19, 2024Updated last year
- Protein structural disorder prediction☆20Nov 21, 2024Updated last year
- Documentation for Open OnDemand generated using Sphinx☆19Feb 20, 2026Updated last week
- A Tutorial for quasi Markov State Model(qMSM) developed by Huang Group, Dept of Chemistry at UW-Madison☆19Jun 6, 2023Updated 2 years ago
- A collection of useful functions for bioinformatics data analysis☆25Feb 5, 2026Updated 3 weeks ago
- GUI for Boltz☆33Jun 11, 2025Updated 8 months ago
- Various integrations to the Schrodinger ecosystem. With major interest on analysis tools for Molecular Dynamics simulations run with Desm…☆23Jan 29, 2026Updated last month
- Component for displaying KPI widgets on a Streamlit dashboard☆18Aug 25, 2021Updated 4 years ago
- ☆21Mar 25, 2025Updated 11 months ago
- PandaDock: Physics based Molecular Docking with GNN Scoring☆95Updated this week
- This component implements a selectbox that allows free text input. It is based on React-Select's 'Select' component.☆22Jun 18, 2025Updated 8 months ago
- Software package for FEP☆22Updated this week
- A Streamlit component based on React Image Crop.☆21Jun 1, 2022Updated 3 years ago
- A machine learning based protein disorder predictor.☆27Oct 28, 2025Updated 3 months ago
- An Angular app where tasks can be created, read, updated and deleted and completed. The state management was done with Reactive, function…☆20Oct 12, 2017Updated 8 years ago