Models, Molecular

"Models, Molecular" is a descriptor in the National Library of Medicine's controlled vocabulary thesaurus, MeSH (Medical Subject Headings). Descriptors are arranged in a hierarchical structure, which enables searching at various levels of specificity.

MeSH information

Definition | Details | More General Concepts | Related Concepts | More Specific Concepts

Models used experimentally or theoretically to study molecular shape, electronic properties, or interactions; includes analogous molecules, computer-generated graphics, and mechanical structures.

Descriptor ID	D008958
MeSH Number(s)	E05.599.595
Concept/Terms	Models, Molecular Models, Molecular Molecular Models Model, Molecular Molecular Model

Below are MeSH descriptors whose meaning is more general than "Models, Molecular".

Analytical, Diagnostic and Therapeutic Techniques and Equipment [E]
Investigative Techniques [E05]
Models, Theoretical [E05.599]
Models, Molecular [E05.599.595]

Below are MeSH descriptors whose meaning is related to "Models, Molecular".

Below are MeSH descriptors whose meaning is more specific than "Models, Molecular".

publications

Timeline | Most Recent

This graph shows the total number of publications written about "Models, Molecular" by people in this website by year, and whether "Models, Molecular" was a major or minor topic of these publications.

Bar chart showing 788 publications over 30 distinct years, with a maximum of 58 publications in 2010

To see the data from this visualization as text, click here.

Year	Major Topic	Minor Topic	Total
1996	2	1	3
1997	0	6	6
1998	1	5	6
1999	0	5	5
2000	0	11	11
2001	1	13	14
2002	1	23	24
2003	3	33	36
2004	6	27	33
2005	5	37	42
2006	7	45	52
2007	7	32	39
2008	7	35	42
2009	3	33	36
2010	5	53	58
2011	8	46	54
2012	12	36	48
2013	9	35	44
2014	4	35	39
2015	3	39	42
2016	3	23	26
2017	1	24	25
2018	5	24	29
2019	3	24	27
2020	5	12	17
2021	2	6	8
2022	0	6	6
2023	0	1	1
2024	2	6	8
2025	0	7	7

Below are the most recent publications written about "Models, Molecular" by people in Profiles.

Hasan MM, Tarkhaneh O, Bungay SD, Poirier RA, Islam SM. Predicting HOMO-LUMO Gaps Using Hartree-Fock Calculated Data and Machine Learning Models. J Chem Inf Model. 2025 Sep 22; 65(18):9497-9515.

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Zhang S, Yi R, An L, Liu J, Yao X, Li S, Zhang K. Structural insights into higher-order natural RNA-only multimers. Nat Struct Mol Biol. 2025 Oct; 32(10):2012-2021.

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Acosta-Mercado J, Oliveras-Alsina A, Marcano-Maiz AI, Rivera-Torres AP, Cordero-Gimenez KT, Malavez-Cajigas S, Bayro MJ, Ramos-Benitez MJ, Pi?ero Cruz DM. Evaluating Naphthalene-Modified Metallosalen Complexes as Anticancer Agents. J Med Chem. 2025 Jul 24; 68(14):14300-14311.

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Sato K, Uehara S, Tsugita A, Ishii M, Ishiyama S, Maejima A, Nakahara I, Nazuka M, Matsui T, Christos G, Yokoyama T, Kumagai I, Makabe K, Asano R, Tanaka Y. Bispecific antibody-antigen complex structures reveal activity enhancement by domain rearrangement. Cell Rep. 2025 Jul 22; 44(7):115965.

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Maniaci B, Mealka M, Bobkov AA, Stec B, Huxford T, Love JJ. Incorporating Metal-Ligand and Salt-Bridge Interactions in the Design of Protein Heterodimers. Biochemistry. 2025 Aug 05; 64(15):3237-3247.

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Gao N, Mazzoletti D, Peng A, Olinares PDB, Morrone C, Garavaglia A, Gouda N, Tsoy S, Mendoza A, Chowdhury A, Cerullo A, Bhavsar H, Rossi F, Rizzi M, Chait BT, Miggiano R, Jeruzalmi D. DnaB and DciA: mechanisms of helicase loading and translocation on ssDNA. Nucleic Acids Res. 2025 Jun 20; 53(12).

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Genta M, Ferrara G, Capelli R, Rondelli D, Sertic S, Bolognesi M, Rizzi M, Rossi F, Jeruzalmi D, Chaves-Sanjuan A, Miggiano R. Mechanistic understanding of UvrA damage detection and lesion hand-off to UvrB in Nucleotide Excision Repair. Nat Commun. 2025 Apr 10; 16(1):3416.

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Dumas A, Goyal N, Mottamal M, Afosah DK, Al-Horani RA. Discovery of a new lead molecule to develop a novel class of human factor XIIa inhibitors. J Thromb Thrombolysis. 2024 Dec; 57(8):1308-1314.

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Wang T, Li Z, Xu K, Huang W, Huang G, Zhang QC, Yan N. CryoSeek: A strategy for bioentity discovery using cryoelectron microscopy. Proc Natl Acad Sci U S A. 2024 Oct 15; 121(42):e2417046121.

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Suryajaya W, Biswas T, Shahabi S, Mealka M, Huxford T, Ghosh G. HDX-MS Analysis of Catalytic Activation of IKK2 in the I?B Kinase Complex. Biochemistry. 2024 09 17; 63(18):2323-2334.

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