Artigos com autorizações de acesso público - Peter C St. JohnSaiba mais
2 artigos não disponíveis publicamente
Effect of the β-hydroxy group on ester reactivity: Combustion kinetics of methyl hexanoate and methyl 3-hydroxyhexanoate
SY Mohamed, N Naser, G Fioroni, J Luecke, Y Kim, PCS John, ...
Combustion and Flame 258, 113071, 2023
Autorizações: US Department of Energy
Designing high-performance fuels through graph neural networks for predicting cetane number of multicomponent surrogate mixtures
Y Kim, S Kumar, J Cho, N Naser, W Ko, PCS John, RL McCormick, S Kim
SAE Technical Paper, 2023
Autorizações: US National Science Foundation, US Department of Energy
64 artigos disponíveis publicamente
Identification of Small Molecule Activators of Cryptochrome
T Hirota, JW Lee, PC St. John, M Sawa, K Iwaisako, T Noguchi, ...
Science 337 (6098), 1094, 2012
Autorizações: US National Institutes of Health
Modification of silk fibroin using diazonium coupling chemistry and the effects on hMSC proliferation and differentiation
AR Murphy, PC St. John, DL Kaplan
Biomaterials 29 (19), 2829-2838, 2008
Autorizações: US National Institutes of Health
Prediction of organic homolytic bond dissociation enthalpies at near chemical accuracy with sub-second computational cost
PC St. John, Y Guan, Y Kim, S Kim, RS Paton
Nature Communications 11 (1), 1-12, 2020
Autorizações: US National Science Foundation, US Department of Energy
Innovative chemicals and materials from bacterial aromatic catabolic pathways
CW Johnson, D Salvachúa, NA Rorrer, BA Black, DR Vardon, PCS John, ...
Joule 3 (6), 1523-1537, 2019
Autorizações: US Department of Energy
Measuring and predicting sooting tendencies of oxygenates, alkanes, alkenes, cycloalkanes, and aromatics on a unified scale
DD Das, PC St. John, CS McEnally, S Kim, LD Pfefferle
Combustion and Flame 190, 349-364, 2018
Autorizações: US National Science Foundation, US Department of Energy
Message-passing neural networks for high-throughput polymer screening
PC St. John, C Phillips, TW Kemper, AN Wilson, Y Guan, MF Crowley, ...
The Journal of chemical physics, 2019
Autorizações: US Department of Energy
Quantum chemical calculations for over 200,000 organic radical species and 40,000 associated closed-shell molecules
PC St John, Y Guan, Y Kim, BD Etz, S Kim, RS Paton
Scientific Data 7 (1), 1-6, 2020
Autorizações: US National Science Foundation, US Department of Energy
Importance of engineered and learned molecular representations in predicting organic reactivity, selectivity, and chemical properties
LC Gallegos, G Luchini, PC St. John, S Kim, RS Paton
Accounts of Chemical Research 54 (4), 827-836, 2021
Autorizações: US National Science Foundation, US Department of Energy
Real-time prediction of 1 H and 13 C chemical shifts with DFT accuracy using a 3D graph neural network
Y Guan, SVS Sowndarya, LC Gallegos, PCS John, RS Paton
Chemical Science 12 (36), 12012-12026, 2021
Autorizações: US National Science Foundation, US Department of Energy
Functional network inference of the suprachiasmatic nucleus
JH Abel, K Meeker, D Granados-Fuentes, PC St. John, TJ Wang, ...
Proceedings of the National Academy of Sciences 113 (16), 4512-4517, 2016
Autorizações: US Department of Energy, US National Institutes of Health
Succinic acid production from lignocellulosic hydrolysate by Basfia succiniciproducens
D Salvachúa, H Smith, PC St. John, A Mohagheghi, DJ Peterson, ...
Bioresource technology 214, 558-566, 2016
Autorizações: US Department of Energy
Muconic acid production from glucose and xylose in Pseudomonas putida via evolution and metabolic engineering
C Ling, GL Peabody, D Salvachúa, YM Kim, CM Kneucker, CH Calvey, ...
Nature Communications 13 (1), 4925, 2022
Autorizações: US Department of Energy
Spatiotemporal separation of PER and CRY posttranslational regulation in the mammalian circadian clock
PC St. John, T Hirota, SA Kay, FJ Doyle III
Proceedings of the National Academy of Sciences, 201323618, 2014
Autorizações: US National Institutes of Health
Metabolic engineering of Actinobacillus succinogenes provides insights into succinic acid biosynthesis
MT Guarnieri, YC Chou, D Salvachúa, A Mohagheghi, PC St. John, ...
Appl. Environ. Microbiol. 83 (17), e00996-17, 2017
Autorizações: US Department of Energy
Sooting tendencies of co-optima test gasolines and their surrogates
CS McEnally, Y Xuan, PCS John, DD Das, A Jain, S Kim, TA Kwan, ...
Proceedings of the Combustion Institute 37 (1), 961-968, 2019
Autorizações: US National Science Foundation, US Department of Energy
Multi-objective goal-directed optimization of de novo stable organic radicals for aqueous redox flow batteries
SS SV, JN Law, CE Tripp, D Duplyakin, E Skordilis, D Biagioni, RS Paton, ...
Nature Machine Intelligence 4 (8), 720-730, 2022
Autorizações: US National Science Foundation, US Department of Energy
A quantitative model for the prediction of sooting tendency from molecular structure
PC St. John, P Kairys, DD Das, CS McEnally, LD Pfefferle, DJ Robichaud, ...
Energy & Fuels 31 (9), 9983-9990, 2017
Autorizações: US National Science Foundation, US Department of Energy
Performance-advantaged ether diesel bioblendstock production by a priori design
NA Huq, X Huo, GR Hafenstine, SM Tifft, J Stunkel, ED Christensen, ...
Proceedings of the National Academy of Sciences 116 (52), 26421-26430, 2019
Autorizações: US National Science Foundation, US Department of Energy
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