M. Scott Shell

Citation name

Shell, M. S.

Affiliation

UC Santa Barbara

State

CA

Country

USA

Sessions chaired or co-chaired

Spotlights in Thermodynamics and Computational Molecular Science (Invited Talks)

2022 Annual Meeting (ISBN: 978-0-8169-1118-9)

Spotlights in Thermodynamics and Computational Molecular Science (Invited Talks)

2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)

Authored

(523e) Predicting Polyelectrolyte Complex Coacervation from a Molecularly-Informed Field-Theoretic Simulation Approach

Glenn H. Fredrickson

2021 Annual Meeting (ISBN: 978-0-8169-1116-5)

(622a) Inverse Design of Pore Wall Chemistry to Control Solute Transport through Molecular Simulation Coupled Optimization

2022 Annual Meeting (ISBN: 978-0-8169-1118-9)

(360w) Design of Pore Wall Chemistry to Control Solute Transport and Selectivity

2022 Annual Meeting (ISBN: 978-0-8169-1118-9)

(233b) An Extended-Ensemble Relative Entropy Approach to Sequence-Specific Coarse-Grained Models for Peptide Aggregation

2022 Annual Meeting (ISBN: 978-0-8169-1118-9)

(53d) Computational Design of Formulations and Biomaterials through Multiscale Modeling from All-Atom to Field-Theory

Glenn H. Fredrickson

Nicholas Sherck

2022 Annual Meeting (ISBN: 978-0-8169-1118-9)

(383e) Charting the Design Space of Chemically-Heterogeneous Surfaces That Manipulate Water-Mediated Interactions

2022 Annual Meeting (ISBN: 978-0-8169-1118-9)

(357ag) Computational Inverse Design of Multifunctional Surfaces to Control Water and Solute Behavior

Audra DeStefano

Daniela Rivera Mirabal

Rachel Segalman

2022 Annual Meeting (ISBN: 978-0-8169-1118-9)

(515i) Quantifying Peptide Configurational Landscapes and Aggregation through Sequence-Transferable Bottom-up Coarse-Grained Models

2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)

(545j) Developing a Bottom-up Coarse-Grained Model for Sequence-Specific Polypeptoids

Daniela Rivera Mirabal

Audra DeStefano

Rachel Segalman

2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)

Associated proceedings

2021 Annual Meeting

2022 Annual Meeting

2023 AIChE Annual Meeting