Popular repositories Loading
-
vsepr-rs
vsepr-rs PublicA lightweight, high-performance molecular geometry optimizer based on VSEPR theory and spatial hashing, written in Rust.
Rust
-
uff-relax
uff-relax PublicHigh-performance Universal Force Field (UFF) relaxation engine in Rust. Optimized for large-scale molecular systems (100k+ atoms) with CellList and Rayon parallelism.
Rust
-
fbtk
fbtk PublicHigh-performance molecular builder and analysis toolkit for polymers and complex mixtures, powered by Rust.
Rust
-
gasteiger-rs
gasteiger-rs PublicA lightweight, zero-dependency Rust crate for Gasteiger-Marsili PEOE partial atomic charge assignment.
Rust
-
fbqueue
fbqueue PublicA lightweight, robust local job scheduler in Rust. Features resource management, multi-queue support, and PBS compatibility for Linux and Windows.
Rust
If the problem persists, check the GitHub status page or contact support.