Original Research
Accepted on 18 Nov 2024
Exploring TAS2R46 Biomechanics through Molecular Dynamics and Network Analysis
in Biological Modeling and Simulation
Frontiers in Molecular Biosciences
doi 10.3389/fmolb.2024.1473675
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467 articles
Articles
Original Research
Published on 14 Nov 2024
Protein-free domains in native and ferroptosis-driven oxidized cell membranes: a molecular dynamics study of biophysical properties and doxorubicin uptake
in Biological Modeling and Simulation
Frontiers in Molecular Biosciences
doi 10.3389/fmolb.2024.1494257
- 335 views
Original Research
Published on 09 Oct 2024
Exploration of phytoconstituents of Medhya Rasayana herbs to identify potential inhibitors for cerebroside sulfotransferase through high-throughput screening
in Biological Modeling and Simulation
Frontiers in Molecular Biosciences
doi 10.3389/fmolb.2024.1476482
- 902 views
- 1 citation
Correction
Published on 04 Oct 2024
Corrigendum: Deepening insights into cholinergic agents for intraocular pressure reduction: systems genetics, molecular modeling, and in vivo perspectives
in Biological Modeling and Simulation
Frontiers in Molecular Biosciences
doi 10.3389/fmolb.2024.1490100
- 348 views
Original Research
Published on 10 Sep 2024
From in vitro to in silico: a pipeline for generating virtual tissue simulations from real image data
in Biological Modeling and Simulation
Frontiers in Molecular Biosciences
doi 10.3389/fmolb.2024.1467366
- 754 views
Original Research
Published on 06 Sep 2024
A potential allosteric inhibitor of SARS-CoV-2 main protease (Mpro) identified through metastable state analysis
in Biological Modeling and Simulation
Frontiers in Molecular Biosciences
doi 10.3389/fmolb.2024.1451280
- 890 views
- 1 citation
Original Research
Published on 05 Sep 2024
LncSTPred: a predictive model of lncRNA subcellular localization and decipherment of the biological determinants influencing localization
in Biological Modeling and Simulation
Frontiers in Molecular Biosciences
doi 10.3389/fmolb.2024.1452142
- 442 views
Original Research
Published on 13 Aug 2024
Computational insights into the mechanisms underlying structural destabilization and recovery in trafficking-deficient hERG mutants
in Biological Modeling and Simulation
Frontiers in Molecular Biosciences
doi 10.3389/fmolb.2024.1341727
- 954 views
Original Research
Published on 09 Aug 2024
Structural modifications and kinetic effects of KRAS interactions with HRAS and NRAS: an in silico comparative analysis of KRAS mutants
in Biological Modeling and Simulation
Frontiers in Molecular Biosciences
doi 10.3389/fmolb.2024.1436976
- 1,341 views
Original Research
Published on 07 Aug 2024
Discovery of an 8-oxoguanine regulator PCBP1 inhibitor by virtual screening and its synergistic effects with ROS-modulating agents in pancreatic cancer
in Biological Modeling and Simulation
Frontiers in Molecular Biosciences
doi 10.3389/fmolb.2024.1441550
- 1,168 views
Original Research
Published on 05 Aug 2024
Molecular dynamic simulation reveals the inhibiting impact of Rhein on wild-type and P29S-mutated Rac1
in Biological Modeling and Simulation
Frontiers in Molecular Biosciences
doi 10.3389/fmolb.2024.1414197
- 975 views
Methods
Published on 01 Aug 2024
Innovative tree-based method for sampling molecular conformations: exploring the ATP-binding cassette subfamily D member 1 (ABCD1) transporter as a case study
in Biological Modeling and Simulation
Frontiers in Molecular Biosciences
doi 10.3389/fmolb.2024.1440529
- 1,206 views
Original Research
Published on 26 Jul 2024
Deepening insights into cholinergic agents for intraocular pressure reduction: systems genetics, molecular modeling, and in vivo perspectives
in Biological Modeling and Simulation
Frontiers in Molecular Biosciences
doi 10.3389/fmolb.2024.1423351
- 1,877 views
Original Research
Published on 11 Jul 2024
Bibliometric analysis on CRISPR/Cas: a potential Sherlock Holmes for disease detection
in Biological Modeling and Simulation
Frontiers in Molecular Biosciences
doi 10.3389/fmolb.2024.1383268
- 1,247 views
Original Research
Published on 13 Jun 2024
Evaluation of the clinical value of 10 estimating glomerular filtration rate equations and construction of a prediction model for kidney damage in adults from central China
in Biological Modeling and Simulation
Frontiers in Molecular Biosciences
doi 10.3389/fmolb.2024.1408503
- 830 views
- 1 citation
Original Research
Published on 12 Jun 2024
Computational design and investigation of the monomeric spike SARS-CoV-2-ferritin nanocage vaccine stability and interactions
in Biological Modeling and Simulation
Frontiers in Molecular Biosciences
doi 10.3389/fmolb.2024.1403635
- 1,384 views