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Paul Beroza
Publication Activity (10 Years)
Years Active: 1996-2024
Publications (10 Years): 1
Top Topics
Protein Folding
Molecular Dynamics
Nuclear Magnetic Resonance
Contact Map
Top Venues
CoRR
J. Chem. Inf. Model.
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Publications
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Mahdi Ghorbani
,
Leo Gendelev
,
Paul Beroza
,
Michael J. Keiser
Autoregressive fragment-based diffusion for pocket-aware ligand design.
CoRR
(2024)
Yong-Liang Zhu
,
Paul Beroza
,
Dean R. Artis
Including Explicit Water Molecules as Part of the Protein Structure in MM/PBSA Calculations.
J. Chem. Inf. Model.
54 (2) (2014)
Marc Adler
,
Paul Beroza
Improved Ligand Binding Energies Derived from Molecular Dynamics: Replicate Sampling Enhances the Search of Conformational Space.
J. Chem. Inf. Model.
53 (8) (2013)
Santosh Putta
,
Christian Lemmen
,
Paul Beroza
,
Jonathan Greene
A Novel Shape-Feature Based Approach to Virtual Library Screening.
J. Chem. Inf. Comput. Sci.
42 (5) (2002)
Paul Beroza
,
Donald R. Fredkin
Calculation of amino acid pKaS in a protein from a continuum electrostatic model: Method and sensitivity analysis.
J. Comput. Chem.
17 (10) (1996)