LLM for Drug Editing, ICLR 2024
- chatgpt
- conversation
- drug
- drug-discovery
Repository Index
58,632 visible repositories in the index
529–552 of 844 · Most stars
Scientific computing in pure Crystal
- crystal
- linear-algebra
- machine-learning
- autograd
Fork of https://gitlab.mpcdf.mpg.de/mtr/pocketfft to simplify external contributions
Code for "Predicting Cellular Responses to Novel Drug Perturbations at a Single-Cell Resolution", NeurIPS 2022.
- disentanglement
- drug-discovery
- genomics
- perturbation
A framework for high-performance domain decomposition methods.
- c-plus-plus
- linear-algebra
- python
- fortran
TransformerCPI: Improving compound–protein interaction prediction by sequence-based deep learning with self-attention mechanism and label reversal experiments(BIOINFORMATICS 2020) https://doi.org/10.1093/bioinformatics/btaa524
- self-attention
- compound-protein-interaction
- transformercpi
- structure-free-virtual-sreening
The open suite for process plants. Historian, analytics, alarms, dashboards, models and documents, built to work with AI.
The Next Generation Logic Library
The source code for the Menge crowd simulation framework
Optimising chemical reactions using machine learning
- chemistry
- machine-learning
- optimization
- bayesian-optimization
TUM Roborace Team Software Stack - Vehicle Simulation
Safe Bayesian Optimization
- gaussian-processes
- optimization
- robotics
- reinforcement-learning
Interpretable bilinear attention network with domain adaptation improves drug-target prediction.
The repository host gives no description.
Automated 3D brain registration with support for multiple species and atlases.
- registration
- atlases
- brain
- neuroscience
Data visualisation web components for the life sciences.
- biohackeu21
- bioinformatics
- visualization
- webcomponents
Date and time manipulation for modern Fortran
- fortran
- datetime
- timedelta
- strftime
OFF, Open source Finite volume Fluid dynamics code
- fluid-dynamics
- fortran
- oop
- cfd
SolarEstimator: pvlib-based solar estimation platform with Tkinter GUI
- activator
- application
- gui
- pvlib
Chemical 2D structure editor application/applet based on the Chemistry Development Kit
- blueobelisk
- java
- chemistry
FastGenericNew: high-performance generic instantiation for .NET, replacing Activator.CreateInstance<
- activator
- createinstance
- csharp
- csharp-library
Type-safe dependency injection singleton wrapper with lazy init and generic constructor support
- activator
- dependency-injection
- instantiation
- lazy-loading
Accurate and efficient spot detection for microscopy data
Numpy-like library in swift. (Multi-dimensional Array, ndarray, matrix and vector library)
- swift
- math
- ndimensional-arrays
- ndarray