Thomas E. Hadfield - Publications, H-index & Citations

Thomas E. Hadfield

university of oxford

6H指数

10论文数

206被引数

收录论文 5

发表时间

Exploring the ability of machine learning-based virtual screening models to identify the functional groups responsible for binding

JOURNAL OF CHEMINFORMATICS

IF5.7

2023-09-19

OAAI

Hadfield, Thomas E.; Scantlebury, Jack; Deane, Charlotte M.

A Small Step Toward Generalizability: Training a Machine Learning Scoring Function for Structure-Based Virtual Screening

JOURNAL OF CHEMICAL INFORMATION AND MODELING

IF5.3

2023-05-11

OAAI

Scantlebury, Jack; Vost, Lucy; Carbery, Anna; Hadfield, Thomas E.; Turnbull, Oliver M.; Brown, Nathan; Chenthamarakshan, Vijil; Das, Payel; Grosjean, Harold; von Delft, Frank; Deane, Charlotte M.

Incorporating Target-Specific Pharmacophoric Information into Deep Generative Models for Fragment Elaboration

JOURNAL OF CHEMICAL INFORMATION AND MODELING

IF5.3

2022-05-02

OAAI

Hadfield, Thomas E.; Imrie, Fergus; Merritt, Andy; Birchall, Kristian; Deane, Charlotte M.

AI in 3D compound design

CURRENT OPINION IN STRUCTURAL BIOLOGY

IF7

2022-04-01

PREAI

Hadfield, Thomas E.; Deane, Charlotte M.

Deep generative design with 3D pharmacophoric constraints

CHEMICAL SCIENCE

IF7.4

2021-01-01

OAAI

Imrie, Fergus; Hadfield, Thomas E.; Bradley, Anthony R.; Deane, Charlotte M.

研究方向