linresearchgroup / RCGAN_GrapheneView external linksLinks
This repository includes main notebook of the code for our proposed RCGAN
☆12Apr 10, 2020Updated 5 years ago
Alternatives and similar repositories for RCGAN_Graphene
Users that are interested in RCGAN_Graphene are comparing it to the libraries listed below
Sorting:
- [NeurIPS 2025] The official implementation of "T2SMark: Balancing Robustness and Diversity in Noise-as-Watermark for Diffusion Models"☆42Nov 2, 2025Updated 3 months ago
- Next-generation sequencing analysis pipelines & scrips☆10Nov 25, 2020Updated 5 years ago
- ☆29Apr 17, 2022Updated 3 years ago
- Features Based Conformational Clustering of MD trajectories. See details at:☆10Nov 20, 2025Updated 2 months ago
- ☆34Nov 16, 2025Updated 2 months ago
- ☆13Updated this week
- The Density Functional Theory for Electrolyte Solutions☆10Sep 13, 2022Updated 3 years ago
- Python package to model and to perform topology optimization for graphene kirigami using deep learning☆29Jan 28, 2026Updated 2 weeks ago
- Developing a Deep learning classification-based model for screening pharmaceutical compounds with hERG inhibitory activity (cardiotoxicit…☆14Oct 2, 2024Updated last year
- gmx_corr converts the covariance matrix which is produced by GROMACS covar to cross correlation matrix and creates a heat map figure.☆11Oct 11, 2022Updated 3 years ago
- AI for a cure, a combination of Latent-GAN and VAE-JTNN to create 100% valid drug like molecules☆10Mar 16, 2020Updated 5 years ago
- Subplex Optimization Algorithm☆11Nov 25, 2025Updated 2 months ago
- DNA and RNA variant calling pipelines with HLA typing and Neoantigen predictions☆11Jul 8, 2021Updated 4 years ago
- Drug-Target Interaction Prediction Using Convolutional Neural Networks By Images of Compounds☆10Jun 16, 2020Updated 5 years ago
- Gromacs molecular dynamics simulation analysis scripts☆10Apr 5, 2022Updated 3 years ago
- OpenSMOG is a Python library for performing molecular dynamics simulations using Structure-Based Models. OpenSMOG uses OpenMM.☆12Feb 6, 2026Updated last week
- An algorithm that carries out both large-loop and small-loop TEM modeling.☆11Jan 4, 2022Updated 4 years ago
- ProQDock is a Protein-Protein docking scoring program that uses high level coordinate driven features compiled and trained by a Support V…☆11Dec 11, 2021Updated 4 years ago
- rim provides an interface to Maxima for R. Maxima is a powerful and fairly complete computer algebra system.☆11Nov 25, 2025Updated 2 months ago
- User interface to perform quantum transport calculations with non equilibrium Green's functions☆13Aug 14, 2018Updated 7 years ago
- Python implementation of various 2D and 3D compactness measures.☆10Aug 17, 2022Updated 3 years ago
- Extends the CreditKarma interface to allow CSV file imports of 1099-B infomation☆14Apr 18, 2022Updated 3 years ago
- Use batch balanced KNN (BBKNN) in R☆13Sep 9, 2025Updated 5 months ago
- Collection of Tools for Computational Materials Science☆12Nov 1, 2022Updated 3 years ago
- The Chemical Reaction Optimization (CRO) algorithm with dependent classes in python 3.☆11Apr 21, 2020Updated 5 years ago
- Tutorial for the usage of the dcTMD approach and Langevin simulations employing the trypsin-benzamidine complex as example.☆11Jul 15, 2024Updated last year
- [MLHC 2021] Model Selection for Offline RL: Practical Considerations for Healthcare Settings. https://arxiv.org/abs/2107.11003☆10Oct 6, 2022Updated 3 years ago
- A program for the conformational search in flexible acyclic molecules☆10Jul 12, 2022Updated 3 years ago
- A generic PK/PD simulation platform based on rxode2 and mrgsolve engines.☆10Jan 28, 2026Updated 2 weeks ago
- ☆10Apr 22, 2019Updated 6 years ago
- Phylogenetic analyses code☆10Feb 12, 2020Updated 6 years ago
- Provably Secure Steganography in Practice Based on “Distribution Copies”☆42Jun 1, 2025Updated 8 months ago
- ☆10Dec 17, 2020Updated 5 years ago
- Codebase to accompany the paper A Look Inside the Black Box: Using Graph-Theoretical Descriptors to Interpret a Continuous-Filter Convolu…☆12May 26, 2021Updated 4 years ago
- ☆12Jun 12, 2023Updated 2 years ago
- R integration for edlib, a C/C++ library for pairwise sequence alignment using edit distance (Levenshtein distance).☆11Jul 20, 2025Updated 6 months ago
- rlemon - R interface to C++ LEMON graph library☆10Jan 17, 2025Updated last year
- Analyse metabolic stability predictions using SHapley Additive exPlanations.☆11Jul 26, 2023Updated 2 years ago
- Graph Neural Networks for Drug Efficacy Prediction☆11Sep 11, 2022Updated 3 years ago