Solves quadratic equations
A high-performance, pure Rust library and CLI for full-atom protein side-chain packing using the DREIDING force field, Goldstein+Split DEE, and tree-decomposition DP—with native protein-ligand and protein-nucleic acid interface support.
A pure Rust library and CLI for fast, dynamic partial charge calculation via the QEq method.
A pure Rust library and CLI that automates DREIDING force field parameterization by orchestrating structure repair, topology perception, and charge calculation for both biological and chemical systems.
A lightweight, pure Rust, no-std kernel for exact ns Slater-type orbital Coulomb integrals, optimized for both semi-empirical and ab initio methods.
Centralized authentication and authorization API for multiple independent services. Manages users, roles, permissions, and service associations.