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Unrolr: Structural analysis of protein conformations using stochastic proximity embedding

Journal of computational chemistry, 2018-11, Vol.39 (30), p.2551-2557

2018

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D3R Grand Challenge 4: prospective pose prediction of BACE1 ligands with AutoDock-GPU

Journal of computer-aided molecular design, 2019-12, Vol.33 (12), p.1071-1081

2019

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AutoDock Vina 1.2.0: New Docking Methods, Expanded Force Field, and Python Bindings

Journal of chemical information and modeling, 2021-08, Vol.61 (8), p.3891-3898

2021

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A revisited version of the apo structure of the ligand‐binding domain of the human nuclear receptor retinoic X receptor α

Acta crystallographica. Section F, Structural biology communications, 2019-02, Vol.75 (2), p.98-104

2019

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Comparison of affinity ranking using AutoDock-GPU and MM-GBSA scores for BACE-1 inhibitors in the D3R Grand Challenge 4

Journal of computer-aided molecular design, 2019-12, Vol.33 (12), p.1011-1020

2019

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Structural Insights into the Molecular Mechanism of Vitamin D Receptor Activation by Lithocholic Acid Involving a New Mode of Ligand Recognition

Journal of medicinal chemistry, 2014-06, Vol.57 (11), p.4710-4719

2014

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Discovery of small-molecule enzyme activators by activity-based protein profiling

Nature chemical biology, 2020-09, Vol.16 (9), p.997-1005

2020

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A revisited version of the apo structure of the ligand-binding domain of the human nuclear receptor retinoic X receptor α

Acta crystallographica. Section F, Structural biology communications, 2019-01, Vol.75 (2), p.98-104

2019

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WaterKit: Thermodynamic Profiling of Protein Hydration Sites

Journal of chemical theory and computation, 2023-05, Vol.19 (9), p.2535-2556

2023

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Assessment of protein–ligand complexes in CASP15

Proteins, structure, function, and bioinformatics, 2023-12, Vol.91 (12), p.1811-1821

2023

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Automated benchmarking of combined protein structure and ligand conformation prediction

Proteins, structure, function, and bioinformatics, 2023-12, Vol.91 (12), p.1912-1924

2023

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New prediction categories in CASP15

Proteins, structure, function, and bioinformatics, 2023-12, Vol.91 (12), p.1550-1557

2023

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Structural Basis of Altered Potency and Efficacy Displayed by a Major in Vivo Metabolite of the Antidiabetic PPARγ Drug Pioglitazone

Journal of medicinal chemistry, 2019-02, Vol.62 (4), p.2008-2023

2019

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Structural basis of altered potency and efficacy displayed by a major in vivo metabolite of the anti-diabetic PPARγ drug pioglitazone

Journal of medicinal chemistry, 2019-02, Vol.62 (4), p.2008-2023

2019

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Integrative X‑ray Structure and Molecular Modeling for the Rationalization of Procaspase‑8 Inhibitor Potency and Selectivity

ACS chemical biology, 2020-02, Vol.15 (2), p.575-586

2020

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Humanized GPIbα–von Willebrand factor interaction in the mouse

Blood advances, 2018-10, Vol.2 (19), p.2522-2532

2018

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Parallelizing Irregular Computations for Molecular Docking

2020 IEEE/ACM 10th Workshop on Irregular Applications: Architectures and Algorithms (IA3), 2020, p.12-21

2020

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BIODATA DETERMINANTS OF VOCATIONAL TYPOLOGY

EBERHARDT, BRUCE JEROME

1979

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Production and Mechanical Properties of Cu-Al-Ni-Be Shape Memory Alloy Thin Ribbons Using a Cold Co-Rolled Process

Shape memory and superelasticity : advances in science and technology, 2021-06, Vol.7 (2), p.344-352

2021

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Femtosecond time-resolved photoelectron spectroscopy with a vacuum-ultraviolet photon source based on laser high-order harmonic generation

Review of scientific instruments, 2011-06, Vol.82 (6), p.063114-063114-12

2011

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SARS‐CoV‐2 infection as a trigger of humoral response against apolipoprotein A‐1

European journal of clinical investigation, 2021-11, Vol.51 (11), p.e13661-n/a

2021

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Determinants of the presence of CSR committees within european boards of directors

Revue de l'organisation responsable, 2019, Vol.14 (1), p.33

2019

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T Cell Receptor Repertoire Profiling Reveals Breadth of Cellular Responses Against Sars-Cov-2 after Natural Infection and Vaccination in Allogeneic Hematopoietic Stem Cell Transplant Recipients

Blood, 2022-11, Vol.140 (Supplement 1), p.10509-10511

2022

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Unrolr: Structural analysis of protein conformations using stochastic proximity embedding

D3R Grand Challenge 4: prospective pose prediction of BACE1 ligands with AutoDock-GPU

AutoDock Vina 1.2.0: New Docking Methods, Expanded Force Field, and Python Bindings

A revisited version of the apo structure of the ligand‐binding domain of the human nuclear receptor retinoic X receptor α

Comparison of affinity ranking using AutoDock-GPU and MM-GBSA scores for BACE-1 inhibitors in the D3R Grand Challenge 4

Structural Insights into the Molecular Mechanism of Vitamin D Receptor Activation by Lithocholic Acid Involving a New Mode of Ligand Recognition

Discovery of small-molecule enzyme activators by activity-based protein profiling

A revisited version of the apo structure of the ligand-binding domain of the human nuclear receptor retinoic X receptor α

WaterKit: Thermodynamic Profiling of Protein Hydration Sites

Assessment of protein–ligand complexes in CASP15

Automated benchmarking of combined protein structure and ligand conformation prediction

New prediction categories in CASP15

Allostery in Its Many Disguises: From Theory to Applications

Structural Basis of Altered Potency and Efficacy Displayed by a Major in Vivo Metabolite of the Antidiabetic PPARγ Drug Pioglitazone

Structural basis of altered potency and efficacy displayed by a major in vivo metabolite of the anti-diabetic PPARγ drug pioglitazone

Integrative X‑ray Structure and Molecular Modeling for the Rationalization of Procaspase‑8 Inhibitor Potency and Selectivity

Humanized GPIbα–von Willebrand factor interaction in the mouse

Parallelizing Irregular Computations for Molecular Docking

Nivolumab Versus Docetaxel in Previously Treated Patients With Advanced Non-Small-Cell Lung Cancer: Two-Year Outcomes From Two Randomized, Open-Label, Phase III Trials (CheckMate 017 and CheckMate 057)

BIODATA DETERMINANTS OF VOCATIONAL TYPOLOGY

Production and Mechanical Properties of Cu-Al-Ni-Be Shape Memory Alloy Thin Ribbons Using a Cold Co-Rolled Process

Femtosecond time-resolved photoelectron spectroscopy with a vacuum-ultraviolet photon source based on laser high-order harmonic generation

SARS‐CoV‐2 infection as a trigger of humoral response against apolipoprotein A‐1

Determinants of the presence of CSR committees within european boards of directors

T Cell Receptor Repertoire Profiling Reveals Breadth of Cellular Responses Against Sars-Cov-2 after Natural Infection and Vaccination in Allogeneic Hematopoietic Stem Cell Transplant Recipients

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