☆21Jul 16, 2020Updated 5 years ago
Alternatives and similar repositories for sars-cov-2-proteins
Users that are interested in sars-cov-2-proteins are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- TorchMD-NET. This is a simple code to train Schnet using pytorch-lighthing.☆11Nov 10, 2021Updated 4 years ago
- Examples for use of YANK - getyank.org☆12Sep 20, 2021Updated 4 years ago
- MolSSI SARS-CoV-2 Biomolecular Simulation Data and Algorithm Store☆31Dec 16, 2023Updated 2 years ago
- Discontinuous Molecular Dynamics (DMD) Simulation Package☆15Mar 21, 2022Updated 4 years ago
- Implementation of MOFF force field. Please cite us at Latham, A; Zhang, B J. Chem. Theory Comput. 2021, 17, 3134. (https://pubs.acs.org/d…☆10Jun 16, 2022Updated 3 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.
- A deep learning framework for deubiquitnase-substrate interaction identification☆12Jul 31, 2025Updated 8 months ago
- ☆15Jan 31, 2026Updated 2 months ago
- Sampling-based approach to analyse neural networks using TensorFlow☆23Apr 10, 2019Updated 7 years ago
- ☆15Oct 28, 2020Updated 5 years ago
- Prepare topology and coordinate file for CG models in Genesis.☆13Jul 3, 2025Updated 9 months ago
- GREMLIN - learn MRF/potts model from input multiple sequence alignment! Implementation now available in C++ and Tensorflow/Python!☆59Oct 17, 2022Updated 3 years ago
- Density based object completion over PBC.☆30Dec 10, 2024Updated last year
- Demo of diffusion models #DDPM applied to molecular dynamics of small peptide☆14Jan 26, 2024Updated 2 years ago
- Modeling and Bayesian analysis of fluorescence and absorbance assays.☆20Sep 20, 2021Updated 4 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.
- Personalized Network-based Anti-Cancer Therapy Appointment☆10Dec 22, 2025Updated 3 months ago
- Exploratory work on free energy calculations with GROMACS using "separated topologies" approach (Rocklin et al., 2013).☆28Dec 4, 2024Updated last year
- AqSolDB: A curated aqueous solubility dataset contains 9.982 unique compounds.☆31Apr 18, 2020Updated 6 years ago
- Material from papers from KULL centre☆71May 29, 2024Updated last year
- HiCOPS: Computational framework for peptide identification from MS data through accelerated database search☆10Mar 24, 2023Updated 3 years ago
- Best practice document for alchemical free energy calculations going to livecoms journal☆87Apr 5, 2026Updated 2 weeks ago
- ☆13Mar 26, 2024Updated 2 years ago
- TS2CG: Conversion of triangulated surfaces to (coarse grain) membrane models for molecular simulation☆32Apr 17, 2025Updated last year
- Repository for the molecular structures related with Corona virusses and their re-processing☆64Mar 24, 2025Updated 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.
- A complete waste of time☆15Dec 11, 2022Updated 3 years ago
- ☆35Jul 22, 2019Updated 6 years ago
- A collection of heat engines, based on the OpenAI Gym environment framework for use with reinforcement learning applications.☆15Dec 20, 2021Updated 4 years ago
- An R Package for Discovering Rhythmicity in Biological Data with an Interactive Web Interface☆12Mar 7, 2022Updated 4 years ago
- A fully GPU-accelerated molecular dynamics program for the Martini force field☆35Sep 13, 2023Updated 2 years ago
- PyTorch library of layers acting on protein representations☆119Jun 30, 2024Updated last year
- Quickly generate, start and analyze benchmarks for molecular dynamics simulations.☆82Sep 5, 2024Updated last year
- ☆10Oct 14, 2025Updated 6 months ago
- OpenMM plugin to define forces with neural networks☆219Feb 24, 2025Updated 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.
- A DDG benchmark capture containing the benchmark dataset and benchmarked protocol captures.☆17Jan 31, 2016Updated 10 years ago
- A Python toolkit for the analyis of lipid membrane simulations☆35Oct 24, 2025Updated 5 months ago
- Source code for "Nucleosome plasticity is a critical element of chromatin liquid–liquid phase separation and multivalent nucleosome inter…☆13Jun 17, 2022Updated 3 years ago
- A collections of scripts for working molecular dynamics simulations☆45Feb 6, 2026Updated 2 months ago
- GROMACS implementation of TraPPE-UA force field with HH-Alkane modifications☆14Sep 24, 2022Updated 3 years ago
- An interoperable Python framework for biomolecular simulation.☆153Mar 26, 2026Updated 3 weeks ago
- Unified Free Energy Dynamics (UFED) simulations with OpenMM☆35Aug 20, 2025Updated 8 months ago