Multi-stage Riemannian flow matching for physically valid molecular docking, with GNINA scoring, PoseBusters filtering, CLI inference, and benchmarks.
- alphafold3
- docking
- drug-design
- drug-discovery
Repository Index
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A common lisp library that provides a numeric type with optional unit and/or uncertainty for computations with automatic error propagation.
NASA/JPL SPICE Toolkit for C – patched for cross-platform compatibility
- astronomy
- astronomical-algorithms
- celestial-mechanics
- nasa
Multigrate: multiomic data integration for single-cell genomics
A weather server supporting Campbell Scientific and Davis Instruments stations with lots of data-sharing options
CancerFoundation: A single-cell RNA sequencing foundation model to decipher drug resistance in cancer
- cancer
- foundation-model
- single-cell
3D shape analysis using deep learning
- cancer-biology
- cell-biology
- deep-learning
- geometric-deep-learning
DE-9IM spatial predicate library implemented in Javascript.
- de-9im
- spatial
- predicates
- javascript
A metaheuristic optimization framework
- optimization
- optimization-algorithms
- optimization-methods
- genetic-algorithm
Pascal library for arbitrary precision BCD floating point numbers
- pascal
- arbitrary-precision
- math
- bignumber
A Swift Playground visualizing gravity based on Einstein's Theory of General Relativity
tiny linear interpolation library for go
- linear-interpolation
- golang
- piecewise
- linear
Numpy like array object for common lisp
Single-cell fluorescence microscopy data analysis
- microscopy
- fluorescence-microscopy-imaging
Arbitrary Precision Library for Delphi with Support for Integer and Floating Point Computations.
Fast, deterministic cell-type deconvolution for million-bin spatial transcriptomics
- bioinformatics
- cell-type-deconvolution
- computational-biology
- deconvolution
Java Scientific Computing Library - Signal Processing, FFT, Filters, PSD, DCT, SciPy-like APIs for JVM & Android used in Machine Learning and Data Science.
- android
- java
- python
- scipy
Nova DSO Tracker is an open-source Flask application for astrophotographers, providing real-time tracking of deep-sky objects' altitude, observability prediction, and integration with Stellarium and SIMBAD databases.
An ordinary differential equation solving library in golang.
- ode
- solving-library
- multivariate
- differential-equations
Data logistics system enabling real-time pathogen surveillance. Built for the Seattle Flu Study.
- postgres
- postgresql
- python
- infectious-disease
Ring solver for Idris
Lisp Linear Algebra
- common-lisp
- linear-algebra
An effort to consolidate the needs and plans of individuals and organizations using Common Lisp to meet their numerical and scientific computing needs.
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