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Chodera lab // MSKCC

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teletype-terminal-2.jpg

Chodera lab // MSKCC

Changing drug discovery one ratio of partition functions at a time

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Chodera lab // MSKCC

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NEWS

July 16, 2023

CADD GRC 2023 talk

July 16, 2023/ John Chodera

I’m thrilled to have the opportunity to speak about the COVID Moonshot (and its successor, ASAP) at the 2023 Computer Aided Drug Discovery Gordon Research Conference. A copy of my slides can be found here: [PDF]

July 16, 2023/ John Chodera/ Comment
talks
CADD GRC, talks, slides, talk slides, John Chodera, COVID Moonshot, antivir, asap

John Chodera

July 15, 2019

Slides from the 2019 CADD GRC meeting in Mount Snow, VT

July 15, 2019/ John Chodera

I was thrilled to have a chance to speak in the free energy session at the 2019 Computer Aided Drug Design (CADD) Gordon Research Conference (GRC) in Mount Snow, VT on 15 July 2019! You can find a PDF copy of my slides here: [PDF]
PDF of my pitch for the 202X GRC concept: [PDF]

July 15, 2019/ John Chodera/ Comment
meetings
talks, CADD GRC, GRC, CADD, free energy

John Chodera

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Chodera lab // MSKCC

The Chodera lab at the Memorial Sloan-Kettering Cancer Center

RECENT PUBLICATIONS

Featured
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Nov 17, 2024
Prospective evaluation of structure-based simulations reveal their ability to predict the impact of kinase mutations on inhibitor binding
Nov 17, 2024
Nov 17, 2024
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Sep 25, 2024
Nutmeg and SPICE: Models and data for biomolecular machine learning
Sep 25, 2024
Sep 25, 2024
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Sep 10, 2024
Lessons learned during the journey of data: from experiment to model for predicting kinase affinity, selectivity, polypharmacology, and resistance
Sep 10, 2024
Sep 10, 2024
espaloma-0.3.jpg
Jun 26, 2024
Machine-learned molecular mechanics force fields from large-scale quantum chemical data
Jun 26, 2024
Jun 26, 2024

RECENT NEWS

Featured
2025-05-16 Foundry Breakthrough Research poster - thumbnail.jpg
May 19, 2025
ML Foundry AI for Science Symposium
May 19, 2025
May 19, 2025
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Dec 6, 2024
ELLIS ML4Molecules Workshop in Berlin
Dec 6, 2024
Dec 6, 2024
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Nov 3, 2024
Postdoctoral Fellow Maria A. Castellanos wins poster prize at Computational Medicinal Chemistry School for AlphaFold-based prediction of antiviral spectrum
Nov 3, 2024
Nov 3, 2024

RECENT TWEETS