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Paul Helquist

University of Notre Dame

43H指数
320论文数
6.7K被引数
收录论文 95
发表时间
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Rapid FF Generation via Hessian-Informed Initial Parameters and Automated Refinement
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2025-12-01
err0
PREAI
errFarrugia, Mikaela; Helquist, Paul; Norrby, Per-Ola; Wiest, Olaf
err分享
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Synthesis of Caged HMG-CoA Reductase Substrates for the Elucidation of Cellular Pathways
errJOURNAL OF ORGANIC CHEMISTRY
IF3.6
err2024-12-06
err0
PREAI
errO'Connell, Ryan J.; Dolphin, Nicholas J.; Ferraudi, Guillermo; Lee, Mijoon; Stauffacher, Cynthia V.; Helquist, Paul; Wiest, Olaf
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Mutant induced neurons and humanized mice enable identification of NiemannPick type C1 proteostatic therapies
errJCI INSIGHT
IF6.1
err2024-08-29
err0
errOAAI
errAzaria, Ruth D.; Correia, Adele B.; Schache, Kylie J.; Zapata, Manuela; Pathmasiri, Koralege C.; Mohanty, Varshasnata; Nannapaneni, Dharma T.; Ashfeld, Brandon L.; Helquist, Paul; Wiest, Olaf; Ohgane, Kenji; Li, Qingqing; Fredenburg, Ross A.; Blagg, Brian S. J.; Cologna, Stephanie M.; Schultz, Mark L.; Lieberman, Andrew P.
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Finding Relevant Retrosynthetic Disconnections for Stereocontrolled Reactions为立体控制反应寻找相关的逆向合成断开
errJOURNAL OF CHEMICAL INFORMATION AND MODELING
IF5.3
err2024-07-12
err0
PREAI
errWiest, Olaf; Bauer, Christoph; Helquist, Paul; Norrby, Per-Ola; Genheden, Samuel
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pH-dependent reaction triggering in PmHMGR crystals for time-resolved crystallography
errBIOPHYSICAL JOURNAL
IF3.1
err2024-03-01
err2
PREAI
errPurohit, Vatsal; Steussy, Calvin N.; Rosales, Anthony R.; Critchelow, Chandra J.; Schmidt, Tim; Helquist, Paul; Wiest, Olaf; Mesecar, Andrew; Cohen, Aina E.; V. Stauffacher, Cynthia
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Interplay of Computation and Experiment in Enantioselective Catalysis: Rationalization, Prediction, and-Correction?对映选择性催化中计算与实验的相互作用: 合理化，预测和校正？
errACS CATALYSIS
IF13.1
err2023-10-26
err9
PREAI
errMaloney, Michael P.; Stenfors, Brock A.; Helquist, Paul; Norrby, Per-Ola; Wiest, Olaf
err分享
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Negative Data in Data Sets for Machine Learning Training
errJOURNAL OF ORGANIC CHEMISTRY
IF3.6
err2023-04-26
err17
PREAI
errMaloney, Michael P.; Coley, Connor W.; Genheden, Samuel; Carson, Nessa; Helquist, Paul; Norrby, Per-Ola; Wiest, Olaf
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Biocompatible, Multi-Mode, Fluorescent, T2 MRI Contrast Magnetoelectric-Silica Nanoparticles (MagSiNs), for On-Demand Doxorubicin Delivery to Metastatic Cancer Cells
errPHARMACEUTICALS
IF4.8
err2022-09-30
err6
errOAAI
errWaters, Margo; Hopf, Juliane; Tam, Emma; Wallace, Stephanie; Chang, Jordan; Bennett, Zach; Aquino, Hadrian; Roeder, Ryan K.; Helquist, Paul; Stack, M. Sharon; Nallathamby, Prakash D.
err分享
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A Quantum-Guided Molecular Mechanics Force Field for the Ferrocene Scaffold
errJOURNAL OF ORGANIC CHEMISTRY
IF3.6
err2022-09-06
err2
PREAI
errWahlers, Jessica; Rosales, Anthony R.; Berkel, Neil; Forbes, Aaron; Helquist, Paul; Norrby, Per-Ola; Wiest, Olaf
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Proofreading experimentally assigned stereochemistry through Q2MM predictions in Pd-catalyzed allylic aminations
errNATURE COMMUNICATIONS
IF15.7
err2021-11-18
err8
errOAAI
errWahlers, Jessica; Margalef, Jessica; Hansen, Eric; Bayesteh, Armita; Helquist, Paul; Dieguez, Montserrat; Pamies, Oscar; Wiest, Olaf; Norrby, Per-Ola
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Stereoselectivity Predictions for the Pd-Catalyzed 1,4-Conjugate Addition Using Quantum-Guided Molecular Mechanics
errJOURNAL OF ORGANIC CHEMISTRY
IF3.6
err2021-03-26
err9
errOAAI
errWahlers, Jessica; Maloney, Michael; Salahi, Farbod; Rosales, Anthony R.; Helquist, Paul; Norrby, Per-Ola; Wiest, Olaf
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Microsecond timescale MD simulations at the transition state of PmHMGR predict remote allosteric residues
errCHEMICAL SCIENCE
IF7.4
err2021-01-01
err9
errOAAI
errQuinn, Taylor R.; Steussy, Calvin N.; Haines, Brandon E.; Lei, Jinping; Wang, Wei; Sheong, Fu Kit; Stauffacher, Cynthia, V; Huang, Xuhui; Norrby, Per-Ola; Helquist, Paul; Wiest, Olaf
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HSP90 inhibitors reduce cholesterol storage in Niemann-Pick type C1 mutant fibroblasts
errJOURNAL OF LIPID RESEARCH
IF4.1
err2021-01-01
err14
errOAAI
errPipalia, Nina H.; Saad, Syed Z.; Subramanian, Kanagaraj; Cross, Abigail; Al-Motawa, Aisha; Garg, Kunal; Blagg, Brian S. J.; Neckers, Len; Helquist, Paul; Wiest, Olaf; Ory, Daniel S.; Maxfield, Frederick R.
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Design, Synthesis, and Evaluation of a Luminescent Cholesterol Mimic
errJOURNAL OF ORGANIC CHEMISTRY
IF3.6
err2020-12-28
err4
errOAAI
errWork, Emily M.; Ferraudi, Guillermo; Kiefer, Luke; Liu, Gang; Grigalunas, Michael; Bhardwaj, Atul; Kaur, Rasmin; Dempsey, Janel M.; Wuestner, Daniel; Helquist, Paul; Wiest, Olaf
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Transition State Force Field for the Asymmetric Redox-Relay Heck Reaction
errJOURNAL OF THE AMERICAN CHEMICAL SOCIETY
IF15.6
err2020-05-14
err25
errOAAI
errRosales, Anthony R.; Ross, Sean P.; Helquist, Paul; Norrby, Per-Ola; Sigman, Matthew S.; Wiest, Olaf
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2-Hydroxypropyl-β-cyclodextrin is the active component in a triple combination formulation for treatment of Niemann-Pick C1 disease
errBIOCHIMICA ET BIOPHYSICA ACTA-MOLECULAR AND CELL BIOLOGY OF LIPIDS
IF3.3
err2019-10-01
err27
errOAAI
errDavidson, Jessica; Molitor, Elizabeth; Moores, Samantha; Gale, Sarah E.; Subramanian, Kanagaraj; Jiang, Xuntian; Sidhu, Rohini; Kell, Pamela; Zhang, Jesse; Fujiwara, Hideji; Davidson, Cristin; Helquist, Paul; Melancon, Bruce J.; Grigalunas, Michael; Liu, Gang; Salahi, Farbod; Wiest, Olaf; Xu, Xin; Porter, Forbes D.; Pipalia, Nina H.; Cruz, Dana L.; Holson, Edward B.; Schaffer, Jean E.; Walkley, Steven U.; Maxfield, Frederick R.; Ory, Daniel S.
err分享
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Time-Resolved Crystallography Measurements Elucidating the Mechanism of Bacterial HMG-CoA Reductase
errBIOPHYSICAL JOURNAL
IF3.1
err2019-02-01
err0
errOAAI
errPurohit, Vatsal; Steussy, Calvin; Schmidt, Tim; Critchelow, Chandra J.; Rosales, Tony; Stauffacher, Cynthia; Helquist, Paul; Weist, Olaf
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Mechanistic Study of the Nickel-Catalyzed α,β-Coupling of Saturated Ketones
errACS CATALYSIS
IF13.1
err2018-01-29
err13
PREAI
errZhang, Xin; Tutkowski, Brandon; Oliver, Allen; Helquist, Paul; Wiest, Olaf
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Application of Q2MM to predictions in stereoselective synthesis
errCHEMICAL COMMUNICATIONS
IF4.2
err2018-01-01
err48
errOAAI
errRosales, Anthony R.; Quinn, Taylor R.; Wahlers, Jessica; Tomberg, Anna; Zhang, Xin; Helquist, Paul; Wiest, Olaf; Norrby, Per-Ola
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Revisiting the Stereodetermining Step in Enantioselective Iridium-Catalyzed Imine Hydrogenation重新审视对映选择性铱催化的亚胺氢化中的立体确定步骤
errACS CATALYSIS
IF13.1
err2017-12-19
err39
errOAAI
errTutkowski, Brandon; Kerdphon, Sutthichat; Lime, Elaine; Helquist, Paul; Andersson, Pher G.; Wiest, Olaf; Norrby, Per-Ola
err分享
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研究方向

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合作学者
合作期刊
F
Frederick R. Maxfield
H 指数: 104 · 论文数: 346
M
Matthew S. Sigman
H 指数: 99 · 论文数: 578
L
Len Neckers
H 指数: 94 · 论文数: 393
D
Dieter Enders
H 指数: 92 · 论文数: 1.2K
P
Peter J. Meikle
H 指数: 79 · 论文数: 544
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