System and method for molecular reconstruction and probability distributions using a 3D variational-conditioned generative adversarial network
US11263534B1 · kind B1 · utility
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Key dates
| Filing date | Aug 11, 2021 |
| Grant date | Mar 1, 2022 |
| Priority date | — |
| Expiry date | Aug 11, 2041 |
Classification
- Technology area (CPC G)Physics
- CPC primaryG16C20/90
- WIPO fieldComputer technology
- WIPO sectorElectrical engineering
Abstract
A system and method that produces an accurate probability distribution representative of a target molecule that may be used in pharmacokinetics and analogous applications. A generator is seeded from a variational autoencoder during training and is then used after training in series with a second variational autoencoder to produce the probability distributions from molecular tensors.
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