Skip to main navigation
Skip to search
Skip to main content
the University of Bath's research portal Home
Help & FAQ
Home
Profiles
Research output
Projects
Datasets
Student theses
Equipment
Research units
Activities
Prizes
Press/Media
Search by expertise, name or affiliation
Toby Lewis-Atwell
Mr
Postgraduate Research Student
,
Department of Computer Science
Doctor of Philosophy
,
Department of Computer Science
Doctor of Philosophy
,
UKRI CDT in Accountable, Responsible and Transparent AI
https://orcid.org/0000-0002-0918-8754
Email
tla25
bath.ac
uk
Overview
Fingerprint
Network
Research output
(5)
Datasets
(2)
Similar Profiles
(4)
Research output
3
Article
2
Review article
Research output per year
Research output per year
2 results
Publication Year, Title
(descending)
Publication Year, Title
(ascending)
Title
Type
Filter
Review article
Search results
2022
Machine learning activation energies of chemical reactions
Lewis-Atwell, T.
, Townsend, P. A. &
Grayson, M. N.
,
7 Jul 2022
,
In:
WIREs Computational Molecular Science.
12
,
4
, e1593.
Research output
:
Contribution to journal
›
Review article
›
peer-review
Open Access
File
Activation Energy
100%
Learning System
100%
Limitations
14%
Organic Molecule
14%
Energy Difference
14%
46
Citations (SciVal)
305
Downloads (Pure)
2021
Comparisons of Different Force Fields in Conformational Analysis and Searching of Organic Molecules: A Review
Lewis-Atwell, T.
, Townsend, P. A. &
Grayson, M. N.
,
22 Jan 2021
,
In:
Tetrahedron.
79
, 131865.
Research output
:
Contribution to journal
›
Review article
›
peer-review
Open Access
File
Organic Molecule
100%
Energy Engineering
50%
Energy Minimisation
50%
Chemical System
50%
Field Performance
50%
47
Citations (SciVal)
1183
Downloads (Pure)