Alexandre Duval @NeurIPS's Avatar

Alexandre Duval @NeurIPS

@aduvalinho.bsky.social

Co-founder & CSO @Entalpic | AI for materials discovery | PhD in Graph ML, ex-Mila, ex-Amazon | #AIforClimateChange, #AI4Science

326 Followers  |  79 Following  |  14 Posts  |  Joined: 18.11.2024  |  1.923

Latest posts by aduvalinho.bsky.social on Bluesky


๐Ÿ“ฃ Postdoc call!

We are looking for a postdoctoral researcher to work on machine learning research for materials discovery.

All details here: assets-v2.circle.so/4htxv8ljrkzr...

10.06.2025 15:26 โ€” ๐Ÿ‘ 3    ๐Ÿ” 2    ๐Ÿ’ฌ 0    ๐Ÿ“Œ 1

Sharing this AMAZING opportunity:

A postdoc in AI for Materials Discovery at @mila-quebec.bsky.social, with @alexhergar.bsky.social & @drolnick.bsky.social -- the group that took me in during my PhD. Exciting research topic, fantastic Professors, climate change mitigation = strongly recommended :)

02.07.2025 20:32 โ€” ๐Ÿ‘ 4    ๐Ÿ” 2    ๐Ÿ’ฌ 0    ๐Ÿ“Œ 0
Entalpic

@entalpic.bsky.social is 1 year old ๐ŸŽ‚ โ€” and is (finally) getting a website and a visual identity ! entalpic.ai

If you are looking for a nice weekend read, checkout our short blogpost on generative models for materials discovery โ€”> entalpic.ai/gflownets-ai-mโ€ฆ

16.05.2025 14:56 โ€” ๐Ÿ‘ 4    ๐Ÿ” 0    ๐Ÿ’ฌ 0    ๐Ÿ“Œ 0
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Meet Real-time meetings by Google. Using your browser, share your video, desktop, and presentations with teammates and customers.

Hi together,

We are having our second LeMaterial community meeting tomorrow (April 10) at 6PM CET | 9AM LA ๐Ÿ“…

We will be discussing code / paper / datasets releases + ongoing working group progress (generative models, LLMs, data) ๐Ÿคฉ

๐Ÿ‘‰ To join: meet.google.com/mwy-uydd-kvf

09.04.2025 17:42 โ€” ๐Ÿ‘ 1    ๐Ÿ” 0    ๐Ÿ’ฌ 0    ๐Ÿ“Œ 0
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Busy day at the office today ๐Ÿ”ฅ

Good to see Paris being an AI hub ๐Ÿค—๐Ÿ‡ซ๐Ÿ‡ท

With various talks on sustainabliiity, optimizing energy-intensive industrial processes, AI-driven chemistry โš›๏ธ Even one featuring @entalpic.bsky.social at 2:35pm at the Junior stage โ€” drop by to chat with the team ๐Ÿ˜‡

11.02.2025 10:32 โ€” ๐Ÿ‘ 3    ๐Ÿ” 0    ๐Ÿ’ฌ 0    ๐Ÿ“Œ 0
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This week kicked-off earlier than usual with the @cohereforai.bsky.social event hosted in Paris for the AI Action Summit ! Chatting about LLMs, regulations and open source ๐Ÿ˜

Let me know if you are in Paris โ€” would be happy to discuss research, especially related to AI-driven materials discovery ๐Ÿ˜‡

10.02.2025 07:35 โ€” ๐Ÿ‘ 1    ๐Ÿ” 0    ๐Ÿ’ฌ 0    ๐Ÿ“Œ 0

๐Ÿš€ ๐‹๐ž๐Œ๐š๐ญ๐ž๐ซ๐ข๐š๐ฅ ๐œ๐จ๐ฆ๐ฆ๐ฎ๐ง๐ข๐ญ๐ฒ ๐ฆ๐ž๐ž๐ญ๐ข๐ง๐ ๐ฌ ๐š๐ซ๐ž ๐ฅ๐ข๐ฏ๐ž!โฃโฃ
๐–ฉ๐—ˆ๐—‚๐—‡ ๐—Ž๐—Œ ๐ž๐ฏ๐ž๐ซ๐ฒ ๐ฌ๐ž๐œ๐จ๐ง๐ ๐“๐ก๐ฎ๐ซ๐ฌ๐๐š๐ฒ ๐จ๐Ÿ ๐ญ๐ก๐ž ๐ฆ๐จ๐ง๐ญ๐ก ๐—๐—ˆ ๐–พ๐—‘๐—‰๐—…๐—ˆ๐—‹๐–พ ๐– ๐–จ-๐–ฝ๐—‹๐—‚๐—๐–พ๐—‡ ๐—†๐–บ๐—๐–พ๐—‹๐—‚๐–บ๐—…๐—Œ ๐–ฝ๐—‚๐—Œ๐–ผ๐—ˆ๐—๐–พ๐—‹๐—’.โฃโฃ
๐Ÿ“… ๐…๐ž๐› ๐Ÿ๐Ÿ‘ | ๐Ÿ”๐๐Œ ๐๐š๐ซ๐ข๐ฌ | ๐Ÿ—๐€๐Œ ๐‹๐€โฃโฃ
๐Ÿ“ ๐‰๐จ๐ข๐ง ๐—๐—๐—๐—‰๐—Œ://๐—†๐–พ๐–พ๐—.๐—€๐—ˆ๐—ˆ๐—€๐—…๐–พ.๐–ผ๐—ˆ๐—†/๐—†๐—๐—’-๐—Ž๐—’๐–ฝ๐–ฝ-๐—„๐—๐–ฟโฃ
๐–ฃ๐—‚๐—๐–พ ๐—‚๐—‡๐—๐—ˆ ๐–ซ๐–พ๐–ฌ๐–บ๐—๐–พ๐—‹๐—‚๐–บ๐—… & ๐—Œ๐—๐–บ๐—‰๐–พ ๐—๐—๐–พ ๐–ฟ๐—Ž๐—๐—Ž๐—‹๐–พ!โฃโฃ
๐Ÿ‘‰ ๐‚๐ก๐ž๐œ๐ค ๐ญ๐ก๐ž ๐œ๐จ๐ฆ๐ฆ๐ž๐ง๐ญ๐ฌ ๐ญ๐จ ๐ฃ๐จ๐ข๐ง ๐ญ๐ก๐ž ๐‹๐ž๐Œ๐š๐ญ๐ž๐ซ๐ข๐š๐ฅ ๐’๐ฅ๐š๐œ๐ค

06.02.2025 09:53 โ€” ๐Ÿ‘ 1    ๐Ÿ” 1    ๐Ÿ’ฌ 1    ๐Ÿ“Œ 1

๐Ÿค—โš›๏ธ Glad to see that the boom in AI4Science is not going unnoticed, with incredible contributions across the community! It feels good to see @entalpic.bsky.social LeMaterial initiative -- aimed to accelerate materials discovery -- featured among impactful projects !

@hf.co blog--> lnkd.in/gpCAwtrp

10.01.2025 13:37 โ€” ๐Ÿ‘ 2    ๐Ÿ” 1    ๐Ÿ’ฌ 0    ๐Ÿ“Œ 0
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5 AI Predictions for 2025 | LinkedIn Whatโ€™s coming next in the fast-paced world of AI? Join MIT Technology Reviewโ€™s editors on January 16 for โ€œ5 AI Predictions for 2025,โ€ a special LinkedIn Live event exploring transformative trends and ...

Donโ€™t miss your chance to get ahead in 2025!

AI is evolving faster than ever, and the decisions you make today will shape your future success. Join us on January 16 for our LinkedIn Live event, โ€œ5 AI Predictions for 2025.โ€

Register for free today: www.linkedin.com/events/5aipr...

09.01.2025 15:25 โ€” ๐Ÿ‘ 8    ๐Ÿ” 4    ๐Ÿ’ฌ 0    ๐Ÿ“Œ 0
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Big News in AI4Science! โœจ
We are thrilled to launch LeMaterial, an open-source project in collaboration with @hf.co to accelerate materials discovery โš›๏ธ๐Ÿค—

Discover LeMat-Bulk: a 6.7M-entry dataset standardizing and unifying Materials Project, Alexandria and OQMD

11.12.2024 18:34 โ€” ๐Ÿ‘ 11    ๐Ÿ” 7    ๐Ÿ’ฌ 2    ๐Ÿ“Œ 0
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LeMaterial: an open source initiative to accelerate materials discovery and research Weโ€™re on a journey to advance and democratize artificial intelligence through open source and open science.

Very happy to share LeMaterial (huggingface.co/blog/lemater...) in collaboration with @entalpic.bsky.social and @hf.co working to combine popular quantum chemistry databases like Alexandre, OQMD and MP and deduplicate them. Check out the article below and stay tuned for some more exciting updates!!

11.12.2024 16:54 โ€” ๐Ÿ‘ 16    ๐Ÿ” 5    ๐Ÿ’ฌ 0    ๐Ÿ“Œ 0
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LeMaterial (LeMaterial) AI4Science

5/5) LeMaterial aims to facilitate research in material science: train ML models, identify novel materials & explore chemical spaces.

๐Ÿ‘‰ Explore LeMaterial on Hugging Face: huggingface.co/LeMaterial

๐Ÿ“ข It's just the begging, get involved: docs.google.com/forms/d/1BDG...

11.12.2024 16:49 โ€” ๐Ÿ‘ 0    ๐Ÿ” 0    ๐Ÿ’ฌ 0    ๐Ÿ“Œ 0
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3rd contribution:

๐Ÿ‘‰ A well-benchmark hashing function creating material fingerprints --designed to deduplicate data and evaluate the "novelty" of newly generated materials.

It attempts to answer the question ยซ what is a material ยป, serving as basis for discussion.

11.12.2024 16:49 โ€” ๐Ÿ‘ 0    ๐Ÿ” 0    ๐Ÿ’ฌ 1    ๐Ÿ“Œ 0
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2nd contribution:

๐Ÿ‘‰ Comprehensive tools to analyze the chemical space -- including phase diagrams, visualization tools or elemental composition treemap, empowering researchers to analyze and understand materials at scale.

11.12.2024 16:49 โ€” ๐Ÿ‘ 0    ๐Ÿ” 0    ๐Ÿ’ฌ 1    ๐Ÿ“Œ 0
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LeMaterial/LeMat-Bulk ยท Datasets at Hugging Face Weโ€™re on a journey to advance and democratize artificial intelligence through open source and open science.

1st contribution:

๐Ÿ‘‰LeMat-Bulk: a 6.7M dataset of solid-state materials which cleans, standardizes and unifies Materials Project, Alexandria and OQMD.

huggingface.co/datasets/LeM...

11.12.2024 16:49 โ€” ๐Ÿ‘ 0    ๐Ÿ” 0    ๐Ÿ’ฌ 1    ๐Ÿ“Œ 0
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LeMaterial: an open source initiative to accelerate materials discovery and research Weโ€™re on a journey to advance and democratize artificial intelligence through open source and open science.

โš›๏ธ๐Ÿค— Announcing LeMaterial โš›๏ธ๐Ÿค—

@hf.co & @entalpic.bsky.social are teaming up to release LeMaterial -- an open source initiative aiming to facilitate (AI for) materials discovery !

Datasets, hash function, tools to explore the chemical space & more !

huggingface.co/blog/lemater...

11.12.2024 16:49 โ€” ๐Ÿ‘ 21    ๐Ÿ” 10    ๐Ÿ’ฌ 1    ๐Ÿ“Œ 1

On way to NeurIPS !! ๐Ÿคฉ๐Ÿงณ

Super happy to catch up or meet new faces, so drop me a message if you would like to chat

Interested in everything but special shoutout to AI4Science or materials discovery ๐Ÿค—โš›๏ธ

09.12.2024 16:07 โ€” ๐Ÿ‘ 2    ๐Ÿ” 0    ๐Ÿ’ฌ 0    ๐Ÿ“Œ 0

Mila Mila | Entalpic: A startup leveraging generative AI to reducโ€ฆ

25.11.2024 12:28 โ€” ๐Ÿ‘ 0    ๐Ÿ” 0    ๐Ÿ’ฌ 0    ๐Ÿ“Œ 0

๐Ÿ“ข Entalpic is a @mila-quebec.bsky.social startup !
After spending some fantastic research years in the lab of @drolnick.bsky.social and @yoshuabengio.bsky.social -- with my cofounder @vict0rsch.bsky.social -- we are happy to preserve that link ! ๐Ÿคฉ

25.11.2024 11:34 โ€” ๐Ÿ‘ 2    ๐Ÿ” 0    ๐Ÿ’ฌ 1    ๐Ÿ“Œ 1

@aduvalinho is following 20 prominent accounts