Zobrazeno 1 - 10
of 243
pro vyhledávání: '"Angela K. Wilson"'
Publikováno v:
ACS Omega, Vol 9, Iss 38, Pp 39554-39563 (2024)
Externí odkaz:
https://doaj.org/article/a9ea6d6de7644d3786d060a7b1792281
Autor:
Zaheer Ul-Haq, Angela K, Wilson
Frontiers in Computational Chemistry presents contemporary research on molecular modeling techniques used in drug discovery and the drug development process: computer aided molecular design, drug discovery and development, lead generation, lead optim
Autor:
Niyaz R. Beysengulov, Øyvind S. Schøyen, Stian D. Bilek, Jonas B. Flaten, Oskar Leinonen, Morten Hjorth-Jensen, Johannes Pollanen, Håkon Emil Kristiansen, Zachary J. Stewart, Jared D. Weidman, Angela K. Wilson
Publikováno v:
PRX Quantum, Vol 5, Iss 3, p 030324 (2024)
The generation and evolution of entanglement in many-body systems is an active area of research that spans multiple fields, from quantum information science to the simulation of quantum many-body systems encountered in condensed matter, subatomic phy
Externí odkaz:
https://doaj.org/article/6b168435b4a74dde99d05af5dc393c2c
Autor:
Zaheer Ul Haq, Angela K. Wilson
Frontiers in Computational Chemistry presents contemporary research on molecular modeling techniques used in drug discovery and the drug development process: computer aided molecular design, drug discovery and development, lead generation, lead optim
Publikováno v:
Frontiers in Chemistry, Vol 11 (2023)
Atomic charge and its distribution across molecules provide important insight into chemical behavior. Though there are many studies on various routes for the determination of atomic charge, there are few studies that examine the broader impact of bas
Externí odkaz:
https://doaj.org/article/a04bb45b0df146fe89166cc8f5edacfa
Publikováno v:
ACS Omega, Vol 6, Iss 23, Pp 15103-15114 (2021)
Externí odkaz:
https://doaj.org/article/6b4163e9c45544ea9d8e57db03af7a13
Publikováno v:
ACS Omega, Vol 2, Iss 7, Pp 3214-3227 (2017)
Externí odkaz:
https://doaj.org/article/738dc655d53b49b89f3c16637847cea6
Publikováno v:
Journal of Chemical Information and Modeling. 62:4569-4578
Perfluoroalkyl and polyfluoroalkyl substances (PFASs) are a class of chemicals widely used in industrial applications due to their exceptional properties and stability. However, they do not readily degrade in the environment and are linked to contami
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::0e330b7fc40bf8f43d6406b18d95ad63
https://doi.org/10.1021/acs.jcim.2c00374
https://doi.org/10.1021/acs.jcim.2c00374
Autor:
David Kuntz, Angela K. Wilson
Publikováno v:
Pure and Applied Chemistry. 94:1019-1054
Machine learning and artificial intelligence are increasingly gaining in prominence through image analysis, language processing, and automation, to name a few applications. Machine learning is also making profound changes in chemistry. From revisitin
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::03dadfec0f9d12a3e3cbd7f4b2838890
https://doi.org/10.1515/pac-2022-0202
https://doi.org/10.1515/pac-2022-0202
Autor:
Sasha C. North, Angela K. Wilson
Publikováno v:
The Journal of Physical Chemistry A. 126:3027-3042
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::567b57ecc823cac5adbcb68a2cdc415c
https://doi.org/10.1021/acs.jpca.2c01007
https://doi.org/10.1021/acs.jpca.2c01007