Suman Sirimulla

Lead, Informatics And Computational Pharmacology

El Paso, Texas, United States
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Summary

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Senior
🎓
Top School
Suman Sirimulla is a computational pharmacology leader with over a decade of experience applying machine learning, PBPK modeling, and cheminformatics to advance drug discovery and development. He has led cross-disciplinary teams and built open-source tools and curated databases that are used by both academic groups and pharmaceutical companies. At Expert Systems, Inc. he combines PBPK simulations, population modeling, and DDI predictions with ML-driven bioactivity and ADMET models to support FIH and formulation strategies. Previously he scaled ultra-large library screening and bespoke cheminformatics for Roivant’s QUAISAR platform and ran an academic research program that produced widely reused software. Trained as a pharmacist with a PhD in Medicinal Chemistry, he uniquely bridges hands-on modeling, data engineering, and collaborative medicinal chemistry.
code10 years of coding experience
bookPhD, Medicinal Chemistry, PhD, Medicinal Chemistry at The University of Texas at El Paso
bookB.Pharmacy, Pharmacy, B.Pharmacy, Pharmacy at Rajiv Gandhi University of Health Sciences
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Github Skills (12)

binding10
scoring10
affinity10
proteins7
prediction7
discovery7
deep-learning6
autodock5
drug-discovery5
machine-learning-models4
machine-learning3
tensorflow3

Programming languages (4)

C++ShellHTMLPython

Github contributions (5)

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ssirimulla/vinaSH

Mar 2018 - Apr 2020

VinaSH: Improved Autodock Vina that accounts for Sigma Hole interactions.
Contributions:2 commits, 2 PRs, 7 pushes in 2 years 1 month
autodock-vinaimprovedautodockvinaaccounts
ssirimulla/vinaXB

Jun 2015 - Jun 2016

Contributions:11 pushes, 1 branch in 1 year 1 month
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Suman Sirimulla - Lead, Informatics And Computational Pharmacology