Skip to main page content
U.S. flag

An official website of the United States government

Dot gov

The .gov means it’s official.
Federal government websites often end in .gov or .mil. Before sharing sensitive information, make sure you’re on a federal government site.

Https

The site is secure.
The https:// ensures that you are connecting to the official website and that any information you provide is encrypted and transmitted securely.

Access keys NCBI Homepage MyNCBI Homepage Main Content Main Navigation

Search Page

Filters

My Custom Filters

Publication date

Text availability

Article attribute

Article type

Additional filters

Article Language

Species

Sex

Age

Other

Search Results

10,410 results

Filters applied: . Clear all
Results are displayed in a computed author sort order. The Publication Date timeline is not available.
Page 1
Novel Physics-Based Ensemble Modeling Approach That Utilizes 3D Molecular Conformation and Packing to Access Aqueous Thermodynamic Solubility: A Case Study of Orally Available Bromodomain and Extraterminal Domain Inhibitor Lead Optimization Series.
Hong RS, Mattei A, Sheikh AY, Bhardwaj RM, Bellucci MA, McDaniel KF, Pierce MO, Sun G, Li S, Wang L, Mondal S, Ji J, Borchardt TB. Hong RS, et al. Among authors: sun g. J Chem Inf Model. 2021 Mar 22;61(3):1412-1426. doi: 10.1021/acs.jcim.0c01410. Epub 2021 Mar 4. J Chem Inf Model. 2021. PMID: 33661005
Effect of Polymer Additives on the Crystal Habit of Metformin HCl.
Bellucci MA, Marx A, Wang B, Fang L, Zhou Y, Greenwell C, Li Z, Becker A, Sun G, Brandenburg JG, Sekharan S. Bellucci MA, et al. Among authors: sun g. Small Methods. 2023 Jun;7(6):e2201692. doi: 10.1002/smtd.202201692. Epub 2023 Mar 25. Small Methods. 2023. PMID: 36965154
Tale of Two Polymorphs: Investigating the Structural Differences and Dynamic Relationship between Nirmatrelvir Solid Forms (Paxlovid).
Sadeghi MS, Guo R, Bellucci MA, Quino J, Buckle EL, Nisbet ML, Yang Z, Greenwell C, Gorka DE, Pickard Iv FC, Wood GPF, Sun G, Wen SH, Krzyzaniak JF, Meenan PA, Hancock BC, Yang XH. Sadeghi MS, et al. Among authors: sun g. Mol Pharm. 2024 Aug 5;21(8):3800-3814. doi: 10.1021/acs.molpharmaceut.3c01074. Epub 2024 Jul 25. Mol Pharm. 2024. PMID: 39051563
Templated Nucleation of Clotrimazole and Ketoprofen on Polymer Substrates.
Bellucci MA, Yuan L, Woollam GR, Wang B, Fang L, Zhou Y, Greenwell C, Sekharan S, Ling X, Sun G. Bellucci MA, et al. Among authors: sun g. Mol Pharm. 2024 Sep 2;21(9):4576-4588. doi: 10.1021/acs.molpharmaceut.4c00491. Epub 2024 Aug 20. Mol Pharm. 2024. PMID: 39163735
Development and Comprehensive Benchmark of a High-Quality AMBER-Consistent Small Molecule Force Field with Broad Chemical Space Coverage for Molecular Modeling and Free Energy Calculation.
Xue B, Yang Q, Zhang Q, Wan X, Fang D, Lin X, Sun G, Gobbo G, Cao F, Mathiowetz AM, Burke BJ, Kumpf RA, Rai BK, Wood GPF, Pickard FC 4th, Wang J, Zhang P, Ma J, Jiang YA, Wen S, Hou X, Zou J, Yang M. Xue B, et al. Among authors: sun g. J Chem Theory Comput. 2024 Jan 23;20(2):799-818. doi: 10.1021/acs.jctc.3c00920. Epub 2023 Dec 29. J Chem Theory Comput. 2024. PMID: 38157475
10,410 results
You have reached the last available page of results. Please see the User Guide for more information.