David Slochower

Computational Chemistry at Vertex Pharmaceuticals. Formerly UCSD with Mike Gilson, Open Force Field, and Penn. @[email protected]

[David Slochower @DRSlochower]

@anthonygitter Exactly.

[David Slochower @DRSlochower]

@rguha Three days unsupported?

[David Slochower @DRSlochower]

Here's an opportunity for an experienced ML/AI scientist to work some of the toughest drug discovery problems with an amazing group.

[Rajarshi Guha (@rguha.bsky.social) @rguha]

Interested in developing & implementing a cutting edge #machinelearning strategy to support therapeutic development across multiple diseases and modalities?
And work with a great team? This role in my team at DCS @VertexPharma is what you should consider
https://t.co/ftEeSl7ypJ

[David Slochower @DRSlochower]

@tiwarylab Doesn't the "leaked information" only apply in the self-docking case?

[David Slochower @DRSlochower]

@proteneer I think it’s the same with pages that share a name too.

[Chaya Stern, PhD @SternChaya]

Are you working on interesting Python tools for #compchem? We'd love to hear about it! Submit your proposals https://t.co/nQrOGmQYf2
#Scipy2024

[David Slochower @DRSlochower]

@tiwarylab Surely you are talking about the espresso cup that’s just barely cropped out of frame on the left.

[Jean-Philip Piquemal @jppiquem]

#compchem Please RT.
2 PhD positions are available in my group in the context of the PhyMol EU project.
DC5 in collaboration with Alexandre Tkatchenko (UL, Luxembourg);
DC6 with Alston Misquitta (QMUL, UK).
All application details are on the website. https://t.co/tK4d9EsQKX

[Paul Nerenberg @el_nerenbergo]

Interested in helping build a science department from scratch? Consider joining us at CMC! We are currently running multiple searches, but I'll highlight our open-rank search in chemistry: https://t.co/Jrfrj1rBJY @Chemjobber

[David Slochower @DRSlochower]

@rguha Did you go off a waterfall at mile 205?

[Elaine Tao @whoiselainetao]

PIP PIP hooray our latest work on simulating the binding of PIP to sodium channels is out now on Biorxiv 💥🍇@yiechanglin @CorryLab
https://t.co/UlprZJ5niA

[David Slochower @DRSlochower]

2023.

[David Slochower @DRSlochower]

@rguha Idyllic.

[dalkescientific @dalkescientific]

Can now generate fingerprints from CXSMILES across alls supported toolkits (RDKit, Open Babel, CDK, and OEChem).

New "csv2fps" tool to generate fingerprints from id/molecule columns of a CSV file (eg, MolPort).

Plus new Python APIs for Butina search, CSV handling and more.

[Kushol Gupta @GuptaPenn]

Registration is still open for our 'Symposium on Structural Mass Spectrometry,' being held in honor of Dr. Walter Englander here @PennMedicine @BMBGGUPENN @BB_UPenn
on Tuesday May 16th 2023! This event is FREE, but registration is required! https://t.co/YrBhj1PULD

[Will Pipatpolkai @WillPPK]

BPS folks! I’ll be presenting my postdoc work in @DelemotteLab at the #bps2023 San Diego. 4pm, Sunday 19th Feb. Protein-lipid interactions 6D. Please come and listen! Another PIP2 talk! #kcnq1 #pip2

[Marco De Vivo @devivo_marco]

Multiple positions available in comp chem in my group, on RNA & ML.

Write me an email.

@IITalk #drugdiscovery #publications
#careerScience

[Madeline E. Kavanagh @mads_chem]

Happy International Day of Women and Girls in Science @ScrippsNWiS @scrippsresearch ! #womeninstemday #diversityandinclusion

[David Mobley @davidlmobley]

Anyone know folks at/working with Google Scholar? We're having some problems with how LiveCoMS journal articles appear in Google Scholar (many articles get collapsed into a single entry) and it would help if we can talk with a human about what we can do to improve the situation.