From post

Erratum to: Close intramolecular sulfur-oxygen contacts: modified force field parameters for improved conformation generation.

, , и . J. Comput. Aided Mol. Des., 27 (3): 293 (2013)

Please choose a person to relate this publication to

To differ between persons with the same name, the academic degree and the title of an important publication will be displayed.

 

Другие публикации лиц с тем же именем

Fully integrated FPGA molecular dynamics simulations., , , , , , , , , и 2 other автор(ы). SC, стр. 67:1-67:31. ACM, (2019)Improved Docking of Polypeptides with Glide., , , и . J. Chem. Inf. Model., 53 (7): 1689-1699 (2013)Selecting an Optimal Number of Binding Site Waters To Improve Virtual Screening Enrichments Against the Adenosine A2A Receptor., , , , и . J. Chem. Inf. Model., 54 (6): 1737-1746 (2014)Protein and ligand preparation: parameters, protocols, and influence on virtual screening enrichments., , , , и . J. Comput. Aided Mol. Des., 27 (3): 221-234 (2013)Erratum to: Close intramolecular sulfur-oxygen contacts: modified force field parameters for improved conformation generation., , и . J. Comput. Aided Mol. Des., 27 (3): 293 (2013)Performance and Analysis of the Alchemical Transfer Method for Binding-Free-Energy Predictions of Diverse Ligands., , , , , , и . J. Chem. Inf. Model., 64 (1): 250-264 (января 2024)Optimized Mappings for Symmetric Range-Limited Molecular Force Calculations on FPGAs., , , , , , , и . FPL, стр. 101-108. IEEE, (2022)Novel Procedure for Modeling Ligand/Receptor Induced Fit Effects, , , , и . Journal of Medicinal Chemistry, 49 (2): 534-553 (2006)PMID: 16420040.A Computational Approach to Enzyme Design: Predicting ω-Aminotransferase Catalytic Activity Using Docking and MM-GBSA Scoring., , , , , , , и . J. Chem. Inf. Model., 54 (8): 2334-2346 (2014)In search of novel ligands using a structure-based approach: a case study on the adenosine A2A receptor., , , , , , и . J. Comput. Aided Mol. Des., 30 (10): 863-874 (2016)