Michael J. Bodkin - Publications, H-index & Citations

Michael J. Bodkin

evotec

17H指数

60论文数

6.2K被引数

收录论文 18

发表时间

Design of the Global Health chemical diversity library v2 for screening against infectious diseases

PLOS NEGLECTED TROPICAL DISEASES

IF3.4

2023-12-27

OAAI

Wilson, Caroline; Gardner, J. Mark F.; Gray, David W.; Baragana, Beatriz; Wyatt, Paul G.; Cookson, Alex; Thompson, Stephen; Mendoza-Martinez, Cesar; Bodkin, Michael J.; Gilbert, Ian H.; Tarver, Gary J.

Hotspot Identification and Drug Design of Protein-Protein Interaction Modulators Using the Fragment Molecular Orbital Method

JOURNAL OF CHEMICAL INFORMATION AND MODELING

IF5.3

2022-08-08

OAAI

Monteleone, Stefania; Fedorov, Dmitri G.; Townsend-Nicholson, Andrea; Southey, Michelle; Bodkin, Michael; Heifetz, Alexander

Therapeutic Potential of Targeting Plasminogen Activator Inhibitor-1 in COVID-19

TRENDS IN PHARMACOLOGICAL SCIENCES

IF19.9

2021-06-01

OAAI

Kellici, Tahsin F.; Pilka, Ewa S.; Bodkin, Michael J.

Small-molecule modulators of serine protease inhibitor proteins (serpins)

DRUG DISCOVERY TODAY

IF7.5

2021-02-01

PREAI

Kellici, Tahsin F.; Pilka, Ewa S.; Bodkin, Michael J.

Enhancing reaction-based de novo design using a multi-label reaction class recommender

JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN

IF3.1

2020-02-28

OAAI

Ghiandoni, Gian Marco; Bodkin, Michael J.; Chen, Beining; Hristozov, Dimitar; Wallace, James E. A.; Webster, James; Gillet, Valerie J.

Development and Application of a Data-Driven Reaction Classification Model: Comparison of an Electronic Lab Notebook and Medicinal Chemistry Literature

JOURNAL OF CHEMICAL INFORMATION AND MODELING

IF5.3

2019-09-17

OAAI

Ghiandoni, Gian Marco; Bodkin, Michael J.; Chen, Beining; Hristozov, Dimitar; Wallace, James E. A.; Webster, James; Gillet, Valerie J.

Large-scale analysis of water stability in bromodomain binding pockets with grand canonical Monte Carlo

COMMUNICATIONS CHEMISTRY

IF6.2

2018-04-05

OAAI

Aldeghi, Matteo; Ross, Gregory A.; Bodkin, Michael J.; Essex, Jonathan W.; Knapp, Stefan; Biggin, Philip C.

Statistical Analysis on the Performance of Molecular Mechanics Poisson-Boltzmann Surface Area versus Absolute Binding Free Energy Calculations: Bromodomains as a Case Study

JOURNAL OF CHEMICAL INFORMATION AND MODELING

IF5.3

2017-08-24

108

OAAI

Aldeghi, Matteo; Bodkin, Michael J.; Knapp, Stefan; Biggin, Philip C.

Predictions of Ligand Selectivity from Absolute Binding Free Energy Calculations

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

IF15.6

2017-01-09

136

OAAI

Aldeghi, Matteo; Heifetz, Alexander; Bodkin, Michael J.; Knapp, Stefan; Biggin, Philip C.

Predicting Ligand Selectivity Across Bromodomain Families

BIOPHYSICAL JOURNAL

IF3.1

2016-02-01

OAAI

Aldeghi, Matteo; Heifetz, Alexander; Bodkin, Michael J.; Knapp, Stefan; Biggin, Philip C.

Accurate calculation of the absolute free energy of binding for drug molecules

CHEMICAL SCIENCE

IF7.4

2016-01-01

254

OAAI

Aldeghi, Matteo; Heifetz, Alexander; Bodkin, Michael J.; Knappcd, Stefan; Biggin, Philip C.

Modeling of ribonucleic acid-ligand interactions

WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE

IF27

2015-09-14

PREAI

Stefaniak, Filip; Chudyk, Ewa I.; Bodkin, Michael; Dawson, Wayne K.; Bujnicki, Janusz M.

Absolute Binding Free Energy Calculations of Bromodomain Inhibitors

BIOPHYSICAL JOURNAL

IF3.1

2015-01-01

OAAI

Aldeghi, Matteo; Knapp, Stefan; Heifetz, Alexander; Barker, John J.; Bodkin, Michael J.; Law, Richard J.; Biggin, Philip C.

Extending in silico mechanism-of-action analysis by annotating targets with pathways: application to cellular cytotoxicity readouts

FUTURE MEDICINAL CHEMISTRY

IF3.4

2014-12-22

OAAI

Liggi, Sonia; Drakakis, Georgios; Koutsoukas, Alexios; Cortes-Ciriano, Isidro; Martinez-Alonso, Patricia; Malliavin, Therese E.; Velazquez-Campoy, Adrian; Brewerton, Suzanne C.; Bodkin, Michael J.; Evans, David A.; Glen, Robert C.; Alberto Carrodeguas, Jose; Bender, Andreas

Knowledge-Based Approach to de Novo Design Using Reaction Vectors

JOURNAL OF CHEMICAL INFORMATION AND MODELING

IF5.3

2009-04-21

PREAI

Patel, Hina; Bodkin, Michael J.; Chen, Beining; Gillet, Valerie J.

3D QSAR methods: Phase and catalyst compared

JOURNAL OF CHEMICAL INFORMATION AND MODELING

IF5.3

2007-05-04

PREAI

Evans, David A.; Doman, Thompson N.; Thorner, David A.; Bodkin, Michael J.