☆26Jul 23, 2024Updated 2 years ago
Alternatives and similar repositories for plants_book
Users that are interested in plants_book are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Tutorial using PLANTS (Protein-Ligand ANTSystem)☆13Jul 27, 2024Updated 2 years ago
- Dock organometallic compounds to proteins/DNA/biomolecules☆23May 26, 2025Updated last year
- Docking Tutorial Using Autodock Vina version 1.2.3 (2021) and AutoDock-GPU Version 1.5.3☆32Aug 27, 2024Updated last year
- ☆25Dec 15, 2025Updated 7 months ago
- Computation of the drug-target relative residence times from RAMD simulations☆23Aug 29, 2024Updated last year
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- ☆25Jul 27, 2023Updated 3 years ago
- GaudiMM: A modular optimization platform for molecular design☆32May 10, 2024Updated 2 years ago
- Material for the 3rd i-CoMSE Workshop: Methods for Advanced Sampling☆42May 1, 2023Updated 3 years ago
- Computational Chemistry Workflows☆57Jul 19, 2022Updated 4 years ago
- A machine learned Molecular Mechanics force field with integration into GROMACS and OpenMM☆64Jul 9, 2026Updated 3 weeks ago
- an integrated tool for molecular docking and virtual screening☆84Jun 12, 2026Updated last month
- A multiple-layer inter-molecular contact features based deep neural network for protein-ligand binding affinity prediction☆84Nov 12, 2020Updated 5 years ago
- Automated Quantum Mechanical Environments (AQME) offers transparent and reproducible workflows available for Jupyter Notebooks and comman…☆132Jul 7, 2026Updated 3 weeks ago
- Machine learning approach to detect whether patien has the diabetes or not. Data cleaning, visualization, modeling and cross validation a…☆116Nov 26, 2023Updated 2 years ago
- GPUs on demand by Runpod - Special Offer Available • AdRun AI, ML, and HPC workloads on powerful cloud GPUs—without limits or wasted spend. Deploy GPUs in under a minute and pay by the second.
- Resources, Code, and Other things I use to teach Cheminformatics.☆181Dec 7, 2024Updated last year
- A Python package for molecular docking with an extensive, highly-curated dataset and a set of realistic benchmark tasks for drug discover…☆187May 24, 2026Updated 2 months ago
- PyMolAI provides Agentic interface to PyMol workflows, built on top of Open Source version of PyMol.☆163Feb 23, 2026Updated 5 months ago
- Ant Colony Optimization Algorithm using Python.☆160Feb 28, 2021Updated 5 years ago
- OpenMM tutorial for the MSBS course☆194Mar 19, 2026Updated 4 months ago
- Python API for PaDEL-Descriptor molecular descriptor and fingerprint calculation☆232Jul 25, 2026Updated last week
- Visual Interactive Analysis of Molecular Dynamics☆328Jun 30, 2026Updated last month
- Source code for "DeepDTA: deep drug-target binding affinity prediction"☆302Sep 22, 2023Updated 2 years ago
- 🚂 Python API for Emma's Markov Model Algorithms 🚂☆340Sep 11, 2023Updated 2 years ago
- AI Agents on DigitalOcean Gradient AI Platform • AdBuild production-ready AI agents using customizable tools or access multiple LLMs through a single endpoint. Create custom knowledge bases or connect external data.
- DiffLinker: Equivariant 3D-Conditional Diffusion Model for Molecular Linker Design☆392Apr 17, 2024Updated 2 years ago
- A repository of update in molecular dynamics field by recent progress in machine learning and deep learning.☆344Jan 25, 2026Updated 6 months ago
- Implementation of GeoDiff: a Geometric Diffusion Model for Molecular Conformation Generation (ICLR 2022).☆418May 17, 2023Updated 3 years ago
- Turn any agent into a life science expert with NVIDIA BioNeMo skills.☆403Updated this week
- A Euclidean diffusion model for structure-based drug design.☆520Jun 25, 2025Updated last year
- Semiempirical Extended Tight-Binding Program Package☆823Jul 13, 2026Updated 3 weeks ago
- JASP aims to be a complete statistical package for both Bayesian and Frequentist statistical methods, that is easy to use and familiar to…☆988Updated this week
- A deep learning framework for molecular docking☆958Jun 29, 2026Updated last month
- TeachOpenCADD: a teaching platform for computer-aided drug design (CADD) using open source packages and data☆1,046Jul 23, 2026Updated last week
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- Lectures for INFO8010 Deep Learning, ULiège☆1,294Jul 13, 2026Updated 3 weeks ago
- Implementation of DiffDock: Diffusion Steps, Twists, and Turns for Molecular Docking☆1,558May 2, 2025Updated last year
- Official TestSprite CLI — AI-powered automated testing from your terminal☆2,745Updated this week
- Democratizing Deep-Learning for Drug Discovery, Quantum Chemistry, Materials Science and Biology☆6,910Jul 20, 2026Updated 2 weeks ago
- Turn any AI agent into an AI Scientist. The #1 Agent Skills library for science, used by 170,000+ scientists worldwide. 158 ready-to-use …☆32,500Updated this week
- A hand-picked collection of the finest of resources for the most awesome of agents, Claude Code, the undisputed champion of coding compan…☆51,580Updated this week
- 100+ AI Agents, Agent Skills and RAG Apps - Free and Open Source.☆130,220Updated this week