Rohit Modee @RohitModee
Scientist @BII, A*STAR | Phd @iiit_hyderabad Computational chemist and machine learning researcher. rohitmodee.github.io Hyderabad, India Joined September 2020-
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Continuous leakage of drainage water on Rajapushpa Provincia/ Muppa Road from the last 3 days. Causing great inconvenience to residents & workers in near by communities. @CommissionrGHMC @GHMCOnline @gadwalvijayainc @HMWSSBOnline
Structure prediction of alternative protein conformations | @NatureComms - Cfold, a structure prediction model designed to predict alternative protein conformations. - Train AF2 without the Template Track and focus on MSAs and coevolutionary signals - Predict different…
Structure prediction of alternative protein conformations | @NatureComms - Cfold, a structure prediction model designed to predict alternative protein conformations. - Train AF2 without the Template Track and focus on MSAs and coevolutionary signals - Predict different… https://t.co/2AsX7HbJUc
Dynamic PDB: A New Dataset and a SE(3) Model Extension by Integrating Dynamic Behaviors and Physical Properties in Protein Structures - Dynamic PDB contains 12.6K proteins subjected to 1 microsecond of molecular dynamics simulations with detailed physical properties such as…
Check out my new work with @FrankNoeBerlin where we answer if the structure of different protein conformations really can be predicted. nature.com/articles/s4146… Also try the Colab to see if your protein has different conformations: colab.research.google.com/github/patrick…
I just found a playlist with the lectures of the Rosetta Common Bootcamp (2023): PyRosetta, AlphaFold2, ProteinMPNN, Protein language models and Diffusion models🔥 Protein Modeling and Design with PyRosetta and Machine Learning youtube.com/playlist?list=… 📝 rosettacommons.github.io/PyRosetta.note…
Great new work by Jonas Elsborg and @ArghyaBhowmik5 @DTUEnergy @DTUtweet - 'ArtiSAN: navigating the complexity of material #structures with deep #reinforcementlearning' - iopscience.iop.org/article/10.108… #machinelearning #materials #AI #catalysis #compchem #alloys #energy #graphs
Understatement of the year...
Very exciting to share: AQuaRef- #CryoEM and XRD protein structure refinement with #MachineLearning #QM Teamwork by @MalgoBiczysko @Kavi_Dil @Zubatyuk @adrian_roitberg @waller_lab @hokru_science @PendingAI and @LBNLresearch team 💪 biorxiv.org/content/10.110… #compchem
Excited to share a new pre-print from the lab -- first lead by twitter-less Ross Irwin. In this paper, we present a highly and efficient E(3) equivariant architecture, scale optimal transport. Via flow matching we build an efficient mol. generator arxiv.org/abs/2406.07266
Overcoming the Pitfalls of Computing Reaction Selectivity from Ensembles of Transition States | ChemRxiv - go.shr.lc/4aSL0LI
✔️Registration is open ✔️Great speakers @tiwarylab @drannaduncan @Matth_Chavent @tristanbereau @smnlssn @MicheleCeriotti @FergLab @XuhuiHuangChem @olexandr @gdefabritiis @Rebecca_Wade_C @KarenPalacioR @BettinaGKeller @ChengBingqing... 📍Great place @mpi_polymer 🗓️Sep 17-19,2024
✔️Registration is open ✔️Great speakers @tiwarylab @drannaduncan @Matth_Chavent @tristanbereau @smnlssn @MicheleCeriotti @FergLab @XuhuiHuangChem @olexandr @gdefabritiis @Rebecca_Wade_C @KarenPalacioR @BettinaGKeller @ChengBingqing... 📍Great place @mpi_polymer 🗓️Sep 17-19,2024
#SandeshkhaliCase | "BJP forced me to sign blank papers": Woman withdraws rape complaint against TMC leaders @MickyGupta84 reports
Rahul Gandhi has agreed to do a 1-on-1 debate with Narendra Modi. Will Modi accept?
Shri Rahul Gandhi has accepted the invitation for a public debate with Shri Narendra Modi. And the ball is now in the court of Shri Narendra Modi.
Interested in catalytic simulations? Check out our @cecamEvents workshop in Liguria (Italy) Oct. 7-9, to explore modern approaches (incl. #ML) to simulate catalytic reactivity under realistic conditions! Apply by June 15 through CECAM bit.ly/cecam2024catal… #compchem please RT
@kshatresh Cap must be there for efficient work .. how a professor can guide 10-12 students .. IITs PhD are taking 6-7 years .. as lack of time with professor
We research, build and ship some of the most exciting and challenging products in the world, with passion from Nairobi. Come join us build M365 Copilot. We ❤️ engineers and scientists that ❤️ breaking and building things! jobs.careers.microsoft.com/global/en/shar… @MasakhaneNLP @DeepIndaba
How to start a PhD
Stay tuned for more details on our featured speakers, judges, and in-person locations! Save the date: May 8-9th, 2024. Together, let's unlock new frontiers in materials and chemistry research! eventbrite.com/e/llm-hackatho…
Hey chemtweeps #compchem and ML folks. If you work with LLMs in chemistry and related sciences please consider submitting a paper. This is going to be great focused issue
Hey chemtweeps #compchem and ML folks. If you work with LLMs in chemistry and related sciences please consider submitting a paper. This is going to be great focused issue
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Laboratoire de chimie... @LCC_CNRS
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Make New Home @Make_New_Home
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Anuj Ray @anujray107
81 Followers 345 Following Senior Research Fellow at @iacskolkata | Masters in Chemistry at @nitrourkela | Computational Chemistry | Computational Catalysis | DFT Study | Excited States
Tomoaki Kinjo @tkinjo8
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Keith Butler @keeeto2000
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B.Menon @Binuraj_Menon
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345 Followers 407 Following Associate Professor ; Référent Laïcité et lutte contre le racisme, l'antisémitisme et toute forme de discrimination de @Sorbonne_Univ_
Matthew O’Meara @momeara
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Genki Terashi @GTerashi
231 Followers 146 Following Assistant Research Scientist @Purdue University My research projects: Protein structure modeling, prediction, Protein structure Modeling from cryoEM data.
PostdocVoice @PostdocVoice
31K Followers 19K Following Amplifying the voices of Postdocs. Tag us with #PostdocVoice or @PostdocVoice. Run by @PhDVoice. Independently Run. How To Write An Academic Paper 101 link👇
Ramsha @ramsha_j1
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Kartik Majila @KartikMajila
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Manasvy Group @ManasvyGroup
33 Followers 276 Following Manasvy Group https://t.co/lWZrujIerB has the vision to create wonderful dwellings for people to reside and regenerate.
Oliver Schilter @OSchilter
811 Followers 658 Following PhD Student @IBMResearch | Applying #AI and #MachineLearning to Chemical Engineering | Enthusiastic hiker and chef
Varun Rishi @rishispake
494 Followers 4K Following Computational and Theoretical Chemist @SandiaLabs. Academic journey : @iiserpune @uf @virginia_tech @caltech
KAVITHA PHARMACY @KavithaPharmacy
25 Followers 430 Following Greetings from KAVITHA PHARMACY! KAVITHA PHARMACY provide Home Delivery medicines 🏠 with in 1 hr. Near By KOKAPET areas. You can contact us on +91-7674014522
Kresten Lindorff-Lars... @LindorffLarsen
15K Followers 2K Following Protein and coffee lover, father of two, professor of biophysics and sudo scientist at the #LinderstrømLang Centre for Protein Science 🇩🇰
Alberto Perez @Al__Perez
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Vincent Sitzmann @vincesitzmann
16K Followers 307 Following Teaching AI to see, model, and interact with our 3D world. Assistant Professor @ MIT, leading the Scene Representation Group (https://t.co/h5gvhLYrtw).
Ruchi Anand @ruchianand1975
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Atreyee Banerjee @__atreyee__
603 Followers 343 Following Postdoc @mpi_polymer Previous post doc @Cambridge_Uni PhD @csir_ncl #glasstransition #softmatter #MachineLearning
Mohammad Parsa @mparsa_
31 Followers 283 Following @UCBerkeley PhD student in computational biology: Mixing proteins with AI and hoping they don’t take over the world. #MadScientistInProgress
Christian Dallago @sacdallago
1K Followers 586 Following 🏳️🌈 @NVIDIAEU & @TU_Muenchen. Was @allianz, @vant_ai. BioCS+ML dude. 🦋 @machine.learning.bio https://t.co/m2CTpQUd4u
ICLR 2026 @iclr_conf
53K Followers 55 Following International Conference on Learning Representations #ICLR2026. SPC is @BharathHarihar3 and GC is @cvondrick
Arghya Bhowmik @ArghyaBhowmik5
232 Followers 218 Following Tenured Associate Professor - Technical University of Denmark. Autonomous accelerated multiscale materials design. Energy materials - battery, catalysis.
Brandon Wood @bwood_m
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Janosh @jrib_
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Pierce Lab @pierce_lab
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PostdocJobs.com @PostdocJobs
7K Followers 711 Following The first and the #1 postdoc recruitment service since 1999. For more postdoctoral positions, please visit us at https://t.co/V5uc1TjEvW, or https://t.co/qRN4bHMgyy
Kyrie Zhixuan Zhou @kyriezz78
2K Followers 1K Following Assistant Professor @UTSA @utsacaicc | PhD-ing @UofIllinois @iSchoolUI | Research tech ethics, accessibility, and education | Alumnus @WHU_1893
Ioannis Mitliagkas (�... @bouzoukipunks
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Rose Yu @yuqirose
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Yuyang Wang @YuyangW95
825 Followers 871 Following Research Scientist at @Apple ML Research (MLR) | PhD @CarnegieMellon | Simulate physical world with generative models 🌎🧬
Alishba Imran @alishbaimran_
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Shengchao @Shengchao_Liu
618 Followers 340 Following Assistant Professor @CUHKofficial. Postdoc @UCBerkeley. PhD @Mila_Quebec. Master @UWMadison. Previous intern @facebook, @nvidia and @ServiceNowRSRCH.
Adarsh Kalikadien @AKalikadien
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Yifeng Ding @YifengDing_
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Sarah King @kinglab_pchem
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Julia Westermayr @JWestermayr
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Lars Goerigk @lgoer_compchem
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KoehnGroup @KoehnGroup
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9K Followers 1K Following Imperfect Christ-follower desperately searching for truth, especially through science. Prof @Penn. Director @foldingathome. Legally blind. Father
Kristin Persson @KPatBerkeley
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NCCR-MARVEL @nccr_marvel
2K Followers 429 Following NCCR-MARVEL is the Swiss centre on Computational Design and Discovery of Novel Materials funded by the Swiss National Science Foundation @snf_ch. @EPFL_en
COSMO Lab @lab_COSMO
4K Followers 465 Following Computational Science and Modelling of materials and molecules at the atomic-scale, with machine learning. Join us in the fediverse @[email protected]
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EMBO @EMBO
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