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Steven V. Jerome

Schrodinger Inc.

16H-index
40Paper Count
2.6KCitation Count
Published Papers 18
Publication Date
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DiffDock-Glide: A Hybrid Physics-Based and Data-Driven Approach to Molecular Docking
errJournal of Chemical Information and Modeling
IF5.3
err2026-04-23
err0
PREAI
errLukas Herron; Jumana Dakka; Steven V. Jerome; Kun Yao; Da Shi
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Glide WS: Methodology and Initial Assessment of Performance for Docking Accuracy and Virtual Screening
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2025-12-01
err0
PREAI
errFriesner, Richard A.; Murphy, Robert B.; Zhang, Yuqi; Xiong, Yeyue; Devlaminck, Pierre A.; Tubert-Brohman, Ivan; Jerome, Steven V.
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Identifying Artifacts from Large Library Docking (vol 67 , pg16796-16806 , 2024)
errJOURNAL OF MEDICINAL CHEMISTRY
IF6.8
err2025-10-01
err0
PREAI
errWu, Yujin; Liu, Fangyu; Glenn, Isabella; Fonseca-Valencia, Karla; Paris, Lu; Xiong, Yeyue; Mailhot, Olivier; Jerome, Steven V.; Brooks III, Charles L.; Shoichet, Brian K.
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Enabling In-Silico Hit Discovery Workflows Targeting RNA with Small Molecules
errJournal of Chemical Information and Modeling
IF5.3
err2025-07-08
err0
PREAI
errNikita Chopra; Ara M. Abramyan; Zeineb Si Chaib; Wei Chen; Yeyue Xiong; Anna Bochicchio; David Rinaldo; Steven V. Jerome; Yuqi Zhang
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errSave
Identifying Artifacts from Large Library Docking
errJOURNAL OF MEDICINAL CHEMISTRY
IF6.8
err2024-09-10
err2
PREAI
errWu, Yujin; Liu, Fangyu; Glenn, Isabella; Fonseca-Valencia, Karla; Paris, Lu; Xiong, Yuyue; Jerome, Steven V.; Brooks, Charles L., III; Shoichet, Brian K.
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Shape-Based Virtual Screening of a Billion-Compound Library Identifies Mycobacterial Lipoamide Dehydrogenase Inhibitors
errACS BIO & MED CHEM AU
IF4.3
err2023-09-08
err4
errOAAI
errMichino, Mayako; Beautrait, Alexandre; Boyles, Nicholas A.; Nadupalli, Aparna; Dementiev, Alexey; Sun, Shan; Ginn, John; Baxt, Leigh; Suto, Robert; Bryk, Ruslana; Jerome, Steven V.; Huggins, David J.; Vendome, Jeremie
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Enhancing Hit Discovery in Virtual Screening through Absolute Protein-Ligand Binding Free-Energy Calculations
errJOURNAL OF CHEMICAL INFORMATION AND MODELING
IF5.3
err2023-05-11
err50
PREAI
errChen, Wei; Cui, Di; Jerome, Steven V.; Michino, Mayako; Lenselink, Eelke B.; Huggins, David J.; Beautrait, Alexandre; Vendome, Jeremie; Abel, Robert; Friesner, Richard A.; Wang, Lingle
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Epik: pKa and Protonation State Prediction through Machine Learning
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2023-04-06
err91
PREAI
errJohnston, Ryne C.; Yao, Kun; Kaplan, Zachary; Chelliah, Monica; Leswing, Karl; Seekins, Sean; Watts, Shawn; Calkins, David; Elk, Jackson Chief; Jerome, Steven, V; Repasky, Matthew P.; Shelley, John C.
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Benchmarking Refined and Unrefined AlphaFold2 Structures for Hit Discovery
errJOURNAL OF CHEMICAL INFORMATION AND MODELING
IF5.3
err2023-03-10
err46
PREAI
errZhang, Yuqi; Vass, Marton; Shi, Da; Abualrous, Esam; Chambers, Jennifer M.; Chopra, Nikita; Higgs, Christopher; Kasavajhala, Koushik; Li, Hubert; Nandekar, Prajwal; Sato, Hideyuki; Miller, Edward B.; Repasky, Matthew P.; Jerome, Steven, V
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Efficient Exploration of Chemical Space with Docking and Deep Learning
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2021-09-30
err158
PREAI
errYang, Ying; Yao, Kun; Repasky, Matthew P.; Leswing, Karl; Abel, Robert; Shoichet, Brian K.; Jerome, Steven, V
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Reliable and Accurate Solution to the Induced Fit Docking Problem for Protein-Ligand Binding
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2021-03-29
err73
errOAAI
errMiller, Edward B.; Murphy, Robert B.; Sindhikara, Daniel; Borrelli, Kenneth W.; Grisewood, Matthew J.; Ranalli, Fabio; Dixon, Steven L.; Jerome, Steven; Boyles, Nicholas A.; Day, Tyler; Ghanakota, Phani; Mondal, Sayan; Rafi, Salma B.; Troast, Dawn M.; Abel, Robert; Friesner, Richard A.
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Impact of Different Automated Binding Pose Generation Approaches on Relative Binding Free Energy Simulations
errJOURNAL OF CHEMICAL INFORMATION AND MODELING
IF5.3
err2020-01-28
err21
PREAI
errCappel, Daniel; Jerome, Steven; Hessler, Gerhard; Matter, Hans
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Localized orbital corrections for density functional calculations on transition metal containing systems
errCOORDINATION CHEMISTRY REVIEWS
IF23.5
err2017-08-01
err12
errOAAI
errFriesner, Richard A.; Jerome, Steven V.
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errSave
WScore: A Flexible and Accurate Treatment of Explicit Water Molecules in Ligand-Receptor Docking
errJOURNAL OF MEDICINAL CHEMISTRY
IF6.8
err2016-04-22
err77
PREAI
errMurphy, Robert B.; Repasky, Matthew P.; Greenwood, Jeremy R.; Tubert-Brohman, Ivan; Jerome, Steven; Annabhimoju, Ramakrishna; Boyles, Nicholas A.; Schmitz, Christopher D.; Abel, Robert; Farid, Ramy; Friesner, Richard A.
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Evaluation of the Performance of the B3LYP, PBE0, and M06 DFT Functionals, and DBLOC-Corrected Versions, in the Calculation of Redox Potentials and Spin Splittings for Transition Metal Containing Systems
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2016-02-05
err79
PREAI
errCoskun, Dilek; Jerome, Steven V.; Friesner, Richard A.
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Why a Proximity-Induced Diels-Alder Reaction Is So Fast
errORGANIC LETTERS
IF5
err2012-05-25
err36
errOAAI
errKrenske, Elizabeth H.; Perry, Emma W.; Jerome, Steven V.; Maimone, Thomas J.; Baran, Phil S.; Houk, K. N.
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Charge Model 5: An Extension of Hirshfeld Population Analysis for the Accurate Description of Molecular Interactions in Gaseous and Condensed Phases
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2012-02-03
err787
errOAAI
errMarenich, Aleksandr V.; Jerome, Steven V.; Cramer, Christopher J.; Truhlar, Donald G.
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Strained Cyclophane Macrocycles: Impact of Progressive Ring Size Reduction on Synthesis and Structure
errJOURNAL OF THE AMERICAN CHEMICAL SOCIETY
IF15.6
err2012-01-23
err84
errOAAI
errBogdan, Andrew R.; Jerome, Steven V.; Houk, K. N.; James, Keith
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errSave

Research Directions

No research directions
Co-authors
Cooperation Journals
D
Donald G. Truhlar
H-index: 187 · Papers: 1.9K
K
K. N. Houk
H-index: 157 · Papers: 2.6K
P
Phil S. Baran
H-index: 127 · Papers: 1.1K
B
Brian K. Shoichet
H-index: 114 · Papers: 414
C
Christopher J. Cramer
H-index: 110 · Papers: 864
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