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Journal of chemical information and modeling
Common abbreviations:
J. Chem. Inf. Model. [DE-600]
JCIM [DE-600]
J. Chem. Inf. Comput. Sci [DE-600]
J Chem Inf Model [iso]
J. Chem. Inf. & Comput. Sci. (USA) [DE-600]
J Chem Inf Comput Sci [iso]
J Chem Inf Comp Sci [DE-600]
J. of chem. inform. and comput. sci.,Washington,D.C. [DE-600]
J Chem Inf Model [dnlm]
J Chem Inf Model [iso]
J Chem Inf Comput Sci [dnlm]
J Chem Inf Comput Sci [iso]

Type:journal
DDC:540
Keywords(s): Chemie, Information und Dokumentation, Zeitschrift, Online-Ressource, Chemie, Datenverarbeitung, Zeitschrift, Online-Ressource, Chemie, Information und Dokumentation, Chemie, Datenverarbeitung, Computer Science Applications, Information Systems, General Chemistry, Computational Theory and Mathematics, Library and Information Sciences, General Chemical Engineering
CODEN: CISDB ; JCISD ; JCISD8
ISSN(s): 0095-2338, 1520-5142, 1520-5142 (BIS 44.2004), 1549-9596, 1549-960X
Publisher: American Chemical Society : Washington, DC [2005]-
Country: United States of America
Appears:print, online
ID: PERI:(DE-600)1491237-5

Database coverage:
Medline ; Clarivate Analytics Master Journal List ; Current Contents - Physical, Chemical and Earth Sciences ; Essential Science Indicators ; IF >= 5 ; JCR ; SCOPUS ; Science Citation Index Expanded ; Web of Science Core Collection

Recent Publications

All known publications ...
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Structural Systems Biology Toolkit (SSBtoolkit): From Molecular Structure to Subcellular Signaling Pathways
Journal of chemical information and modeling 65(9), 4257-4262 () [10.1021/acs.jcim.5c00165]  GO BibTeX | EndNote: XML, Text | RIS

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Multiscale Computational Dissection of CCRL2-Mediated Chemerin Presentation
Journal of chemical information and modeling 65(24), 13400-13419 () [10.1021/acs.jcim.5c01871]  GO OpenAccess BibTeX | EndNote: XML, Text | RIS

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An Automated Intermolecular Reaction Discovery Approach Relying on Heuristic Atom-Partitioned Frontier Orbital Features
Journal of chemical information and modeling 65(17), 9125-9141 () [10.1021/acs.jcim.5c00908] special issue: "Chemical Compound Space Exploration by Multiscale High-Throughput Screening and Machine Learning"  GO BibTeX | EndNote: XML, Text | RIS

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CMDmpnn: Combining Comparative Molecular Dynamics and ProteinMPNN to Rapidly Expand Enzyme Substrate Spectrum
Journal of chemical information and modeling 65(6), 2741-2747 () [10.1021/acs.jcim.5c00117]  GO BibTeX | EndNote: XML, Text | RIS

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Fine-Tuning a genetic algorithm for CAMD: a screening-guided warm start
Journal of chemical information and modeling 65(5), 2513-2529 () [10.1021/acs.jcim.4c02038]  GO BibTeX | EndNote: XML, Text | RIS

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FESTA : A Polygon-Based Approach for Extracting Relevant Structures from Free Energy Surfaces Obtained in Molecular Simulations
Journal of chemical information and modeling 65(1), 1-6 () [10.1021/acs.jcim.4c01022]  GO BibTeX | EndNote: XML, Text | RIS

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Impact of Phosphorylation on the Physiological Form of Human alpha-Synuclein in Aqueous Solution
Journal of chemical information and modeling 64(21), 8215-8226 () [10.1021/acs.jcim.4c01172]  GO OpenAccess  Download fulltext Files BibTeX | EndNote: XML, Text | RIS

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Evolutionary Probability and Stacked Regressions Enable Data-Driven Protein Engineering with Minimized Experimental Effort
Journal of chemical information and modeling 64(16), 6350-6360 () [10.1021/acs.jcim.4c00704]  GO BibTeX | EndNote: XML, Text | RIS

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Unexpected Single-Ligand Occupancy and Negative Cooperativity in the SARS-CoV-2 Main Protease
Journal of chemical information and modeling 64(3), 892-904 () [10.1021/acs.jcim.3c01497]  GO OpenAccess  Download fulltext Files BibTeX | EndNote: XML, Text | RIS

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Predictions of the Poses and Affinity of a Ligand over the Entire Surface of a NEET Protein : The Case of Human MitoNEET
Journal of chemical information and modeling 63(2), 643-654 () [10.1021/acs.jcim.2c01280]  GO OpenAccess  Download fulltext Files BibTeX | EndNote: XML, Text | RIS

All known publications ...
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 Record created 2013-01-15, last modified 2026-02-03
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