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Results 1-10 of 21
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Issue Date
Title
Author(s)
10-Apr-2023
Data for "First-principles-based Machine Learning Models for Phase Behavior and Transport Properties of CO2"
Nicola Barbosa Muniz, Maria Carolina
Jul-2020
Data from "Signatures of a liquid-liquid transition in an ab initio deep neural network model for water"
Gartner, Thomas III
;
Zhang, Linfeng
;
Piaggi, Pablo
;
Car, Roberto
;
Panagiotopoulos, Athanassios
;
Debenedetti, Pablo
19-Jun-2023
Data for "Stability and Kinetics of Iron-Terephthalate MOFs with Diverse Structures in Aqueous Pollutant Degradation"
Sarazen, Michele
;
Moore, Samuel
Jun-2023
Achromonodin-1 NMR spectra
Link, A. James
;
Carson, Drew V.
;
So, Larry
;
Cheung-Lee, Wai Ling
3-Dec-2020
Data from "Manifestations of metastable criticality in glassy water-like models detected by large-scale structural properties"
Gartner III, Thomas E.
;
Torquato, Salvatore
;
Car, Roberto
;
Debenedetti, Pablo G.
24-Jun-2021
Data corresponding to our paper on "Chemotactic smoothing of collective migration"
Bhattacharjee, Tapomoy
;
Amchin, Daniel
;
Alert, Ricard
;
Ott, Jenna
;
Datta, Sujit
6-Jun-2023
Thermodynamic and Dynamics Data for Coarse-grained Intrinsically Disordered Proteins Generated by Active Learning
Webb, Michael
;
Jacobs, William
;
An, Yaxin
;
Oliver, Wesley
6-May-2022
Data for Coarse-grained Intrinsically Disordered Proteins
Webb, Michael
;
Patel, Roshan
;
Borca, Carlos
27-Sep-2023
Data from "A Neural Network Water Model Based on the MB-pol Many-Body Potential"
Muniz, Maria Carolina
17-May-2022
Data on Enzyme Activity Retention in glucose oxidase, lipase, and horseradish peroxidase
Webb, Michael
;
Patel, Roshan
;
Gormley, Adam
;
Tamasi, Matt
;
Borca, Carlos
;
Kosuri, Shashank
Discover
Author
4
Webb, Michael
3
Patel, Roshan
2
Borca, Carlos
2
Car, Roberto
2
Debenedetti, Pablo G.
2
Gartner III, Thomas E.
2
Muniz, Maria Carolina
2
Panagiotopoulos, Athanassios Z.
2
Petsev, Nikolai D.
2
Riera, Marc
.
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Subject
1
advanced sampling
1
Biofuels
1
Biomass
1
carbon dioxide
1
CO2
1
Configurations
1
Critical Point
1
crystallization
1
data-driven models
1
Deep-potential molecular dynamics
.
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Date issued
9
2023
6
2022
3
2021
2
2020