Steven D Schwartz (Steven Schwartz)

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 49

Top Topics

Hypertrophic Cardiomyopathy

Molecular Dynamics

Protein Protein

Top Venues

The journal of physical chemistry. B

Journal of chemical information and modeling

The journal of physical chemistry letters

This page only lists publications with an associated author ORCID identifier.

Publications

Sree Ganesh Balasubramani, Kseniia Korchagina, Steven D Schwartz
Transition Path Sampling Study of Engineered Enzymes That Catalyze the Morita-Baylis-Hillman Reaction: Why Is Enzyme Design so Difficult? Journal of chemical information and modeling 64 (6) (2024)
Sree Ganesh Balasubramani, Kseniia Korchagina, Steven D Schwartz
Transition Path Sampling Study of Engineered Enzymes That Catalyze the Morita-Baylis-Hillman Reaction: Why Is Enzyme Design so Difficult? Journal of chemical information and modeling 64 (6) (2024)
Sree Ganesh Balasubramani, Kseniia Korchagina, Steven D Schwartz
Transition Path Sampling Study of Engineered Enzymes That Catalyze the Morita-Baylis-Hillman Reaction: Why Is Enzyme Design so Difficult? Journal of chemical information and modeling 64 (6) (2024)
Sree Ganesh Balasubramani, Kseniia Korchagina, Steven D Schwartz
Transition Path Sampling Study of Engineered Enzymes That Catalyze the Morita-Baylis-Hillman Reaction: Why Is Enzyme Design so Difficult? Journal of chemical information and modeling (2024)
Ananya Chakraborti, Jil C Tardiff, Steven D Schwartz
Myosin-Catalyzed ATP Hydrolysis in the Presence of Disease-Causing Mutations: Mavacamten as a Way to Repair Mechanism. The journal of physical chemistry. B (2024)
Ananya Chakraborti, Jil C Tardiff, Steven D Schwartz
Myosin-Catalyzed ATP Hydrolysis in the Presence of Disease-Causing Mutations: Mavacamten as a Way to Repair Mechanism. The journal of physical chemistry. B 128 (19) (2024)
Ananya Chakraborti, Jil C Tardiff, Steven D Schwartz
Myosin-Catalyzed ATP Hydrolysis in the Presence of Disease-Causing Mutations: Mavacamten as a Way to Repair Mechanism. The journal of physical chemistry. B 128 (19) (2024)
Sree Ganesh Balasubramani, Kseniia Korchagina, Steven D Schwartz
Transition Path Sampling Study of Engineered Enzymes That Catalyze the Morita-Baylis-Hillman Reaction: Why Is Enzyme Design so Difficult? Journal of chemical information and modeling 64 (6) (2024)
Ananya Chakraborti, Jil C Tardiff, Steven D Schwartz
Myosin-Catalyzed ATP Hydrolysis in the Presence of Disease-Causing Mutations: Mavacamten as a Way to Repair Mechanism. The journal of physical chemistry. B 128 (19) (2024)
Bai Hei, Jeanne E Pemberton, Steven D Schwartz
Classical Molecular Dynamics Simulation of Glyonic Liquids: Structural Insights and Relation to Conductive Properties. The journal of physical chemistry. B (2023)
Steven D Schwartz
Protein Dynamics and Enzymatic Catalysis. The journal of physical chemistry. B (2023)
Bai Hei, Jeanne E Pemberton, Steven D Schwartz
Classical Molecular Dynamics Simulation of Glyonic Liquids: Structural Insights and Relation to Conductive Properties. The journal of physical chemistry. B 127 (4) (2023)
Bai Hei, Jeanne E Pemberton, Steven D Schwartz
Classical Molecular Dynamics Simulation of Glyonic Liquids: Structural Insights and Relation to Conductive Properties. The journal of physical chemistry. B 127 (4) (2023)
Bai Hei, Jeanne E Pemberton, Steven D Schwartz
Classical Molecular Dynamics Simulation of Glyonic Liquids: Structural Insights and Relation to Conductive Properties. The journal of physical chemistry. B 127 (4) (2023)
Bai Hei, Jeanne E Pemberton, Steven D Schwartz
Classical Molecular Dynamics Simulation of Glyonic Liquids: Structural Insights and Relation to Conductive Properties. The journal of physical chemistry. B 127 (4) (2023)
Sree Ganesh Balasubramani, Steven D Schwartz
Transition Path Sampling Based Calculations of Free Energies for Enzymatic Reactions: The Case of Human Methionine Adenosyl Transferase and Plasmodium vivax Adenosine Deaminase. The journal of physical chemistry. B 126 (29) (2022)
Clara F Frost, Sree Ganesh Balasubramani, Dimitri Antoniou, Steven D Schwartz
Connecting Conformational Motions to Rapid Dynamics in Human Purine Nucleoside Phosphorylase. The journal of physical chemistry. B 127 (1) (2022)
Clara F Frost, Sree Ganesh Balasubramani, Dimitri Antoniou, Steven D Schwartz
Connecting Conformational Motions to Rapid Dynamics in Human Purine Nucleoside Phosphorylase. The journal of physical chemistry. B 127 (1) (2022)
Andrea E Deranek, Anthony P Baldo, Melissa L Lynn, Steven D Schwartz, Jil C Tardiff
Structure and Dynamics of the Flexible Cardiac Troponin T Linker Domain in a Fully Reconstituted Thin Filament. Biochemistry 61 (13) (2022)
Clara F Frost, Sree Ganesh Balasubramani, Dimitri Antoniou, Steven D Schwartz
Connecting Conformational Motions to Rapid Dynamics in Human Purine Nucleoside Phosphorylase. The journal of physical chemistry. B 127 (1) (2022)
Clara F Frost, Sree Ganesh Balasubramani, Dimitri Antoniou, Steven D Schwartz
Connecting Conformational Motions to Rapid Dynamics in Human Purine Nucleoside Phosphorylase. The journal of physical chemistry. B (2022)
Clara F Frost, Sree Ganesh Balasubramani, Dimitri Antoniou, Steven D Schwartz
Connecting Conformational Motions to Rapid Dynamics in Human Purine Nucleoside Phosphorylase. The journal of physical chemistry. B 127 (1) (2022)
Allison B Mason, Jil C Tardiff, Steven D Schwartz
Free-Energy Surfaces of Two Cardiac Thin Filament Conformational Changes during Muscle Contraction. The journal of physical chemistry. B 126 (21) (2022)
Ananya Chakraborti, Jil C Tardiff, Steven D Schwartz
Insights into the Mechanism of the Cardiac Drug Omecamtiv Mecarbil─A Computational Study. The journal of physical chemistry. B 126 (48) (2022)
Steven D Schwartz
Perspective: Path Sampling Methods Applied to Enzymatic Catalysis. Journal of chemical theory and computation 18 (11) (2022)
Dimitri Antoniou, Steven D Schwartz
Method for Identifying Common Features in Reactive Trajectories of a Transition Path Sampling Ensemble. Journal of chemical theory and computation 18 (6) (2022)
Morais Brown, Ioanna Zoi, Dimitri Antoniou, Hilda A Namanja-Magliano, Steven D Schwartz, Vern L Schramm
Inverse heavy enzyme isotope effects in methylthioadenosine nucleosidases. Proceedings of the National Academy of Sciences of the United States of America 118 (40) (2021)
Anthony P Baldo, Jil C Tardiff, Steven D Schwartz
A Proposed Mechanism for the Initial Myosin Binding Event on the Cardiac Thin Filament: A Metadynamics Study. The journal of physical chemistry letters 12 (14) (2021)
Ananya Chakraborti, Anthony P Baldo, Jil C Tardiff, Steven D Schwartz
Investigation of the Recovery Stroke and ATP Hydrolysis and Changes Caused Due to the Cardiomyopathic Point Mutations in Human Cardiac β Myosin. The journal of physical chemistry. B 125 (24) (2021)
Joseph W Schafer, Xi Chen, Steven D Schwartz
Engineered Tryptophan Synthase Balances Equilibrium Effects and Fast Dynamic Effects. ACS catalysis 12 (2) (2021)
Dimitri Antoniou, Steven D Schwartz
Role of Protein Motions in Catalysis by Formate Dehydrogenase. The journal of physical chemistry. B 124 (43) (2020)
Anthony P Baldo, Jil C Tardiff, Steven D Schwartz
Mechanochemical Function of Myosin II: Investigation into the Recovery Stroke and ATP Hydrolysis. The journal of physical chemistry. B 124 (45) (2020)
Charles M Luft, Elango Munusamy, Jeanne E Pemberton, Steven D Schwartz
A Classical Molecular Dynamics Simulation Study of Interfacial and Bulk Solution Aggregation Properties of Dirhamnolipids. The journal of physical chemistry. B 124 (5) (2020)
Joseph W Schafer, Steven D Schwartz
Directed Evolution's Influence on Rapid Density Fluctuations Illustrates How Protein Dynamics Can Become Coupled to Chemistry. ACS catalysis 10 (15) (2020)
Lukasz Szatkowski, Melissa L Lynn, Teryn Holeman, Michael R Williams, Anthony P Baldo, Jil C Tardiff, Steven D Schwartz
Proof of Principle that Molecular Modeling Followed by a Biophysical Experiment Can Develop Small Molecules that Restore Function to the Cardiac Thin Filament in the Presence of Cardiomyopathic Mutations. ACS omega 4 (4) (2019)
Xi Chen, Steven D Schwartz
Examining the Origin of Catalytic Power of Catechol O-Methyltransferase. ACS catalysis 9 (11) (2019)
Joseph W Schafer, Ioanna Zoi, Dimitri Antoniou, Steven D Schwartz
Optimization of the Turnover in Artificial Enzymes via Directed Evolution Results in the Coupling of Protein Dynamics to Chemistry. Journal of the American Chemical Society 141 (26) (2019)
Natércia F Brás, Pedro Alexandrino Fernandes, Maria João Ramos, Steven D Schwartz
Mechanistic Insights on Human Phosphoglucomutase Revealed by Transition Path Sampling and Molecular Dynamics Calculations. Chemistry (Weinheim an der Bergstrasse, Germany) 24 (8) (2018)
Vern L Schramm, Steven D Schwartz
Promoting Vibrations and the Function of Enzymes. Emerging Theoretical and Experimental Convergence. Biochemistry 57 (24) (2018)
Michael R Williams, Jil C Tardiff, Steven D Schwartz
Mechanism of Cardiac Tropomyosin Transitions on Filamentous Actin As Revealed by All-Atom Steered Molecular Dynamics Simulations. The journal of physical chemistry letters 9 (12) (2018)
Xi Chen, Steven D Schwartz
Directed Evolution as a Probe of Rate Promoting Vibrations Introduced via Mutational Change. Biochemistry 57 (23) (2018)
Charles M Luft, Elango Munusamy, Jeanne E Pemberton, Steven D Schwartz
Molecular Dynamics Simulation of the Oil Sequestration Properties of a Nonionic Rhamnolipid. The journal of physical chemistry. B 122 (14) (2018)
Elango Munusamy, Charles M Luft, Jeanne E Pemberton, Steven D Schwartz
Unraveling the Differential Aggregation of Anionic and Nonionic Monorhamnolipids at Air-Water and Oil-Water Interfaces: A Classical Molecular Dynamics Simulation Study. The journal of physical chemistry. B 122 (24) (2018)
Ryan J Eismin, Elango Munusamy, Laurel L Kegel, David E Hogan, Raina M Maier, Steven D Schwartz, Jeanne E Pemberton
Evolution of Aggregate Structure in Solutions of Anionic Monorhamnolipids: Experimental and Computational Results. Langmuir : the ACS journal of surfaces and colloids 33 (30) (2017)
Elango Munusamy, Charles M Luft, Jeanne E Pemberton, Steven D Schwartz
Structural Properties of Nonionic Monorhamnolipid Aggregates in Water Studied by Classical Molecular Dynamics Simulations. The journal of physical chemistry. B 121 (23) (2017)
Ioanna Zoi, Dimitri Antoniou, Steven D Schwartz
Incorporating Fast Protein Dynamics into Enzyme Design: A Proposed Mutant Aromatic Amine Dehydrogenase. The journal of physical chemistry. B 121 (30) (2017)
Ioanna Zoi, Dimitri Antoniou, Steven D Schwartz
Electric Fields and Fast Protein Dynamics in Enzymes. The journal of physical chemistry letters 8 (24) (2017)
Matthew J Varga, Michael W Dzierlenga, Steven D Schwartz
Structurally Linked Dynamics in Lactate Dehydrogenases of Evolutionarily Distinct Species. Biochemistry 56 (19) (2017)
Mark McConnell, Lauren Tal Grinspan, Michael R Williams, Melissa L Lynn, Benjamin A Schwartz, Ofer Z Fass, Steven D Schwartz, Jil C Tardiff
Clinically Divergent Mutation Effects on the Structure and Function of the Human Cardiac Tropomyosin Overlap. Biochemistry 56 (26) (2017)