Next-Generation
Molecular Physics
The proprietary compute engine powering LatticeZero. Bridging fundamental geometric physics with hardware-accelerated drug discovery.
Not Originally Designed for Biology
One unified mathematical framework.”
First-Principles Physics, Not Fitted Heuristics
The RFT Architecture
Three foundational advances that enable physics-accurate molecular scoring at speeds previously impossible.
Advanced Geometric Discretization
Most docking pipelines use fixed Cartesian sampling and spend substantial compute in low-value pocket volume. RFT uses a scale-invariant geometric framework with proprietary isotropic spatial packing mathematics to evaluate continuous protein pockets with higher volumetric efficiency. This reduces dead-space computation and enables sub-angstrom conformational searches.
Unified Energy Decomposition
Rather than patching together disconnected empirical approximations, the RFT engine evaluates 14 distinct physical interactions, including precise coordination geometries and second-shell hydrophobic effects, from a unified mathematical foundation.
Bare-Metal GPU Parallelization
The RFT engine was designed for matrix-native GPU parallelization, allowing complex energy tensor calculations to run client-side via WebGPU compute shaders at HTVS-class throughput. No server queues are required. Internal RTX 3090 benchmarks exceed 10,000 ligands per second, and internal mobile WebGPU tests on recent iPhone-class hardware reach multi-thousand ligands per second, including runs around 5,000 ligands per second. Workflows that once required cloud farms can now be achieved on a device in your pocket.
Proven on Standard Datasets
Validated against DEKOIS2 with property-matched decoys. Every result includes holdout cross-validation and Y-scramble null controls.
| Target | Family | Validated AUC |
|---|---|---|
| HMGR | Reductase | 0.980 |
| PDE5 | Phosphodiesterase | 0.883 |
| Neuraminidase | Glycosidase | 0.875 |
| MCL1 | Apoptosis Regulator | 0.868 |
| ESR1 | Nuclear Receptor | 0.858 |
| ADRB2 | GPCR | 0.834 |
| CATL | Cysteine Protease | 0.829 |
Validated via 5-fold cross-validation with Y-scramble null controls. All AUC values are holdout-validated on DEKOIS 2.0 with property-matched decoys.
Experience the Engine
The RFT engine is available exclusively through the LatticeZero platform.
Explore LatticeZero