Krzysztof Maziarz
@maziarz.bsky.social
Principal Researcher at Microsoft Research AI for Science, ML for Drug Discovery, ex Google AI & tensorflight
Our retrosynthesis model RetroChimera (previously Chimera) is available via Azure Foundry. Its prediction quality has now surpassed the patent data itself (i.e. in blind tests chemists prefer model outputs over real published reactions). Exciting times ahead 🔥
RetroChimera, now available on Azure AI Foundry, marks a new milestone for predicting synthesis routes to drug-like molecules, opening new possibilities for AI in drug discovery. Learn more: msft.it/6011sutzJ
August 13, 2025 at 6:06 PM
Our retrosynthesis model RetroChimera (previously Chimera) is available via Azure Foundry. Its prediction quality has now surpassed the patent data itself (i.e. in blind tests chemists prefer model outputs over real published reactions). Exciting times ahead 🔥
I recently gave a talk at ML in PL about our recent progress on retrosynthesis prediction; the recording is now out:
youtube.com/watch?v=hfUL...
youtube.com/watch?v=hfUL...
youtube.com
February 5, 2025 at 7:07 PM
I recently gave a talk at ML in PL about our recent progress on retrosynthesis prediction; the recording is now out:
youtube.com/watch?v=hfUL...
youtube.com/watch?v=hfUL...
MatterGen now published in Nature 🔥 Very strong work from the materials team at MSR AI for Science!
Microsoft researchers introduce MatterGen, a model that can discover new materials tailored to specific needs—like efficient solar cells or CO2 recycling—advancing progress beyond trial-and-error experiments. www.microsoft.com/en-us/resear...
January 16, 2025 at 1:08 PM
MatterGen now published in Nature 🔥 Very strong work from the materials team at MSR AI for Science!
Happy to see our recent Chimera model highlighted in MSR's "Research Focus" series! 🔥
NeoMem: hardware/software co-design for CXL-native memory tiering; Chimera: accurate retrosynthesis prediction by ensembling models with diverse inductive biases; GA4GH task execution API enables multicloud task execution: www.microsoft.com/en-us/resear...
December 19, 2024 at 1:28 AM
Happy to see our recent Chimera model highlighted in MSR's "Research Focus" series! 🔥
We just preprinted Chimera: our new retrosynthesis prediction model ⚗️
aka.ms/chimera
It has two modules: a large-scale Transformer and a graph-rewriting GNN. Chimera learns to combine predictions from both to leverage their unique strengths & biases.
Thread below 🧵
aka.ms/chimera
It has two modules: a large-scale Transformer and a graph-rewriting GNN. Chimera learns to combine predictions from both to leverage their unique strengths & biases.
Thread below 🧵
December 11, 2024 at 9:30 PM
We just preprinted Chimera: our new retrosynthesis prediction model ⚗️
aka.ms/chimera
It has two modules: a large-scale Transformer and a graph-rewriting GNN. Chimera learns to combine predictions from both to leverage their unique strengths & biases.
Thread below 🧵
aka.ms/chimera
It has two modules: a large-scale Transformer and a graph-rewriting GNN. Chimera learns to combine predictions from both to leverage their unique strengths & biases.
Thread below 🧵
I'm still new here, so I'll just port my badge posting tradition over from X.
If you're at #NeurIPS2024 and want to chat about AI for Science, come to the MSR booth during one of our slots:
- Tuesday 16:30 - 17:00
- Wednesday 16:30 - 17:30
- Thursday 12:00 - 13:00
If you're at #NeurIPS2024 and want to chat about AI for Science, come to the MSR booth during one of our slots:
- Tuesday 16:30 - 17:00
- Wednesday 16:30 - 17:30
- Thursday 12:00 - 13:00
December 10, 2024 at 10:28 PM
I'm still new here, so I'll just port my badge posting tradition over from X.
If you're at #NeurIPS2024 and want to chat about AI for Science, come to the MSR booth during one of our slots:
- Tuesday 16:30 - 17:00
- Wednesday 16:30 - 17:30
- Thursday 12:00 - 13:00
If you're at #NeurIPS2024 and want to chat about AI for Science, come to the MSR booth during one of our slots:
- Tuesday 16:30 - 17:00
- Wednesday 16:30 - 17:30
- Thursday 12:00 - 13:00