Author

C. I. Bayly

Listed by name: these papers carry no ORCID for this author, so different people with the same name may be mixed together.

Biology Disciplines

Click to filter author papers

Signature Assays, Organisms & Methods

Click to filter · or open tag

Approach:statistical model· 2 Research Focus:benchmarking· 1

Frequent Co-Authors

C. D. Stern· 2 shared D. G. A. Smith· 2 shared D. L. Mobley· 2 shared J. D. Chodera· 2 shared D. L. Dotson· 1 shared J. Fass· 1 shared J. Maat· 1 shared L.-P. Wang· 1 shared

Activity by Year

2020-2022 · peak 1/yr

Co-Author Collaboration Network

8 top collaborators · 24 mutual co-author links

Click any collaborator node to inspect or filter shared papers

Focal author (center)Selected co-authorORCID co-authorUnlinked name

Curved chords = mutual co-authorship

2 shared papersBiophysics

C. D. Stern

Mutual co-authors in cluster

Author profile →

2 papers

Recent·Most cited

Capturing non-local through-bond effects in molecular mechanics force fields: II. Using fractional bond orders to fit torsion parameters

C. D. Stern, J. Maat, D. L. Dotson, C. I. Bayly, D. G. A. Smith, D. L. Mobley, J. D. Chodera

bioRxiv · Jan 17, 2022 · PreprintBiophysics

Capturing non-local through-bond effects in molecular mechanics force fields I: Fragmenting molecules for quantum chemical torsion scans

C. D. Stern, C. I. Bayly, D. G. A. Smith, J. Fass, L.-P. Wang, D. L. Mobley, J. D. Chodera

The paper introduces a method to assess and improve fragmentation schemes for quantum chemical torsion scans by using fractional Wiberg bond orders to preserve chemical environment accuracy.

bioRxiv · Aug 27, 2020 · PreprintBiophysics