LucaCappelletti94 Follow Starred repositories
A Fibonacci Heap implementation in Rust
A priority queue for Rust with efficient change function.
An open implementation of the MC family of maximum clique algorithms
A high-performance, GPU-accelerated library for key computational chemistry tasks, such as molecular similarity, conformer generation, and geometry relaxation.
CLI proxy that reduces LLM token consumption by 60-90% on common dev commands. Single Rust binary, zero dependencies
A Cuda/Thrust implementation of fingerprint similarity searching
Library for computing molecular fingerprint based similarities as well as dimensionality-reduction-based chemical space visualizations.
Code used to analyse and compare different molecular fingerprints.
A Rust implementation of Gaussian Process regression.
SciRS2 - Scientific Computing and AI in Rust., providing SciPy-compatible APIs while leveraging Rust's performance, safety, and concurrency features. Unlike traditional scientific libraries
Universal workbench incorporating msdial, msfinder, and mrmprobs
Serde serializable and deserializable trait objects
MassSpecGym: A benchmark for the discovery and identification of molecules (NeurIPS 2024 Spotlight)
Helios: a unified API for both Exploris and Tribrid MS instruments.
A backend implementation for diesel (https://github.com/diesel-rs/diesel) for oracle sql database.
Times and logs queries executed by diesel
Generate rust structs & query functions from diesel schema files
MS2Query - machine learning assisted library querying of MS/MS spectra
SIMD-accelerated distances, dot products, matrix ops, geospatial & geometric kernels for 16 numeric types — from 6-bit floats to 64-bit complex — across x86, Arm, RISC-V, and WASM, with bindings fo…
RuVector is a High Performance, Real-Time, Self-Learning, Vector Graph Neural Network, and Database built in Rust.
C library for accessing the PostgreSQL parser outside of the server environment
