Ashish @basictesting

We updated the preprint with the version submitted to peer review. Additional speedup: up to 2.7-fold in large protein systems. #compchem Check it out: arxiv.org/abs/2510.06562

Jean-Philip Piquemal @jppiquem

8 months ago

#compchem New preprint: "𝐀𝐜𝐜𝐞𝐥𝐞𝐫𝐚𝐭𝐢𝐧𝐠 𝐌𝐨𝐥𝐞𝐜𝐮𝐥𝐚𝐫 𝐃𝐲𝐧𝐚𝐦𝐢𝐜𝐬 𝐒𝐢𝐦𝐮𝐥𝐚𝐭𝐢𝐨𝐧𝐬 𝐰𝐢𝐭𝐡 𝐅𝐨𝐮𝐧𝐝𝐚𝐭𝐢𝐨𝐧 𝐍𝐞𝐮𝐫𝐚𝐥 𝐍𝐞𝐭𝐰𝐨𝐫𝐤 𝐌𝐨𝐝𝐞𝐥𝐬 𝐮𝐬𝐢𝐧𝐠 𝐌𝐮𝐥𝐭𝐢𝐩𝐥𝐞 𝐓𝐢𝐦𝐞-𝐒𝐭𝐞𝐩 𝐚𝐧𝐝 𝐃𝐢𝐬𝐭𝐢𝐥𝐥𝐚𝐭𝐢𝐨𝐧" in link with our

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Ashish @basictesting

8 months ago

@NVIDIAGeForce Let's Go GeForce!

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As leaders, we often think about what we need to do each day. Just as important is to think about who we want to *be* each day. How we spend our time is important, but what we value and how we treat others is critical to achieving our goals for ourselves and those around us.

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Prof. Feynman @ProfFeynman

10 months ago

Knowledge is like an ocean, vast and infinite. The further you venture, the deeper you realize it goes. Yet, if you only stand at the shore, you may falsely believe you've seen its entirety.

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Jen Heemstra @jenheemstra

10 months ago

We all need mentors, and the further we go in our careers, the more mentors we need. Whether it’s dealing with increasingly complex career situations, considering a career transition, or coping with a career ending, mentors can be an essential source of wisdom and support.

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Jen Heemstra @jenheemstra

10 months ago

If your current career situation is making it tough to just get through each day, then setting goals may feel overwhelming (or ridiculous), but those goals may be critical to helping you weather the storm. More in my latest blog post: jenheemstra.com/resources/goal…

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Ashish @basictesting

10 months ago

Must read. 📚 #books #academic

Jen Heemstra @jenheemstra

10 months ago

Labwork to Leadership officially released today!! I'm humbled by the support from our community, as it's already sold out in most places. But the eBook is available now on kindle & apple books or you can still pick up a hard copy through @Harvard_Press: hup.harvard.edu/books/97806742…