Molecular Informatics
ISSN:1868-1743

Molecular Informatics

MOL INFORM
学科领域:医学
是否预警:不在预警名单内
是否OA:
录用周期:较慢,6-12周
新锐分区:医学3区
年发文量:54
影响因子:3.1
JCR分区:Q1

基本信息

分子信息学是一个经过同行评审的国际论坛,旨在发布有关生物/化学信息学和计算机辅助分子设计所有分子方面的高质量跨学科研究。分子信息学接替了QSAR & 组合科学2010年。分子信息学提出了方法学创新,将导致对配体-受体相互作用、大分子复合物、分子网络、设计概念和过程的更深入的理解,这些概念和过程展示了思想和设计概念如何导致具有所需结构或功能的分子,该杂志的范围包括但不限于药物发现和化学生物学,蛋白质和核酸工程和设计,纳米分子结构的设计,大分子组装的建模策略,分子网络和系统,药物和化学基因组学,计算机辅助筛选策略,以及用于生物活性分子从头设计的新技术。作为独特的特征,分子信息学发表了所谓的 “方法角” 评论类型的文章,这些文章以期刊范围内的重要技术概念和进步为特色。
1868-1743SCIE/Scopus收录
3.1
2.7
2026年3月发布
点击查看历史分区趋势    >
大类学科小类学科Top期刊综述期刊
医学3区
CHEMISTRY, MEDICINAL 药物化学
3区
COMPUTER SCIENCE, INTERDISCIPLINARY APPLICATIONS 计算机:跨学科应用
3区
MATHEMATICAL & COMPUTATIONAL BIOLOGY 数学与计算生物学
2区
N/A
WOS期刊SCI分区  2024-2025最新升级版
按JIF指标学科分区收集子录JIF分区JIF排名百分位
学科:CHEMISTRY, MEDICINAL
SCIE
Q3
42/72
学科:COMPUTER SCIENCE, INTERDISCIPLINARY APPLICATIONS
SCIE
Q2
80/177
学科:MATHEMATICAL & COMPUTATIONAL BIOLOGY
SCIE
Q1
16/67
按JCR指标学科分区收集子录JCR分区JCR排名百分位
学科:CHEMISTRY, MEDICINAL
SCIE
Q2
35/72
学科:COMPUTER SCIENCE, INTERDISCIPLINARY APPLICATIONS
SCIE
Q2
76/177
学科:MATHEMATICAL & COMPUTATIONAL BIOLOGY
SCIE
Q2
22/67
60
54
7%较易较慢,6-12周-CHEMISTRY, MEDICINAL-MATHEMATICAL & COMPUTATIONAL BIOLOGY
3.2%
时间预警情况
2026年03月发布的新锐学术版不在预警名单中
2025年03月发布的2025版不在预警名单中
2024年02月发布的2024版不在预警名单中
2023年01月发布的2023版不在预警名单中
2021年12月发布的2021版不在预警名单中
2020年12月发布的2020版不在预警名单中
92.59%29.66%-
CiteScore:5.90
SJR:0.549
SNIP:0.662
学科类别分区排名百分位
大类:Chemistry
小类:Organic Chemistry
Q2
61 / 212
大类:Chemistry
小类:Computer Science Applications
Q2
276 / 947
大类:Chemistry
小类:Drug Discovery
Q2
59 / 156
大类:Chemistry
小类:Structural Biology
Q2
20 / 49
大类:Chemistry
小类:Molecular Medicine
Q2
87 / 177

期刊高被引文献

Edge Distance‐based Topological Indices of Strength‐weighted Graphs and their Application to Coronoid Systems, Carbon Nanocones and SiO2 Nanostructures
来源期刊:Molecular InformaticsDOI:10.1002/minf.201900039
On the Misleading Use of QF32 \n for QSAR Model Comparison
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800029
Data Curation can Improve the Prediction Accuracy of Metabolic Intrinsic Clearance
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800086
Property Prediction of Organic Donor Molecules for Photovoltaic Applications Using Extremely Randomized Trees
来源期刊:Molecular InformaticsDOI:10.1002/minf.201900038
3D Modeling of Tumor Necrosis Factor Receptor and Tumor Necrosis Factor‐bound Receptor Systems
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800011
Identification of New Potent Acetylcholinesterase Inhibitors Using Virtual Screening and in vitro Approaches
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800118
A Combination of Pharmacophore and Docking‐based Virtual Screening to Discover new Tyrosinase Inhibitors
来源期刊:Molecular InformaticsDOI:10.1002/minf.201900054
Gaussian Process Regression Models for the Prediction of Hydrogen Bond Acceptor Strengths
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800115
Design of Potent Panobinostat Histone Deacetylase Inhibitor Derivatives: Molecular Considerations for Enhanced Isozyme Selectivity between HDAC2 and HDAC8
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800080
Optimal Piecewise Linear Regression Algorithm for QSAR Modelling
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800028
Acute Rat and Mouse Oral Toxicity Determination of Anticholinesterase Inhibitor Carbamate Pesticides: A QSTR Approach
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800151
Predictive Computational Tools for Assessment of Ecotoxicological Activity of Organic Micropollutants in Various Water Sources in Brazil
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800156
Bimolecular Nucleophilic Substitution Reactions: Predictive Models for Rate Constants and Molecular Reaction Pairs Analysis
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800104
Combined Ligand and Fragment‐based Drug Design of Selective Histone Deacetylase – 6 Inhibitors
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800083
Medicinal Chemistry Aware Database GDBMedChem
来源期刊:Molecular InformaticsDOI:10.1002/minf.201900031
Inverse‐QSPR for de novo Design: A Review
来源期刊:Molecular InformaticsDOI:10.1002/minf.201900087
HToPred: A Tool for Human Topoisomerase II Inhibitor Prediction
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800046
Getting to Know the Neighbours with GTM: The Case of Antiviral Compounds
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800166
Modeling the Solubility of C70 Fullerenes in Diverse Solvents: Role of Quantum‐mechanical Descriptors
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800112
Probing Binding Landscapes and Molecular Recognition Mechanisms of Atypical Antipsychotic Drugs towards the Selective Targeting of D2 Dopamine Receptor
来源期刊:Molecular InformaticsDOI:10.1002/minf.201900044
Quinoxalinones Based Aldose Reductase Inhibitors: 2D and 3D‐QSAR Analysis
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800149
Finding Needles in a Haystack: Determining Key Molecular Descriptors Associated with the Blood‐brain Barrier Entry of Chemical Compounds Using Machine Learning
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800164
Filling Data Gaps by Read‐across: A Mini Review on its Application, Developments and Challenges
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800121
Predicting Cytotoxicity and Enzymatic Activity of Diverse Chemicals Using Goldfish Scale Tissue and Topminnow Hepatoma Cell Line‐based Data
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800127
Investigation of Factors Affecting the Performance of in silico Volume Distribution QSAR Models for Human, Rat, Mouse, Dog & Monkey
来源期刊:Molecular InformaticsDOI:10.1002/minf.201900059
Assessments of Algal Toxicity and PBT Behaviour of Pesticides with No Eco‐toxicological Data: Predictive Ability of QSA/(T)R Models
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800137
Application of an Iterative Fragment Selection (IFS) Method to Estimate Entropies of Fusion and Melting Points of Organic Chemicals
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800160
Data Visualization, Regression, Applicability Domains and Inverse Analysis Based on Generative Topographic Mapping
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800088
Comprehensive Exploration of Target‐specific Ligands Using a Graph Convolution Neural Network
来源期刊:Molecular InformaticsDOI:10.1002/minf.201900095
Molecular Modelling of Potential Candidates for the Treatment of Depression
来源期刊:Molecular InformaticsDOI:10.1002/minf.201900024
An Approach to Identify New Insecticides Against Myzus Persicae. In silico Study Based on Linear and Non‐linear Regression Techniques
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800119
Structure‐based Discovery of Novel CK2α‐Binding Cyclic Peptides with Anti‐cancer Activity
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800089
Information Loss in Network Pharmacology
来源期刊:Molecular InformaticsDOI:10.1002/minf.201900032
Identification of Potential Inhibitors of Cathepsin‐B using Shape & Pharmacophore‐based Virtual Screening, Molecular Docking and Explicit Water Thermodynamics
来源期刊:Molecular InformaticsDOI:10.1002/minf.201900023
QSPRs for Molecular Diffusion Coefficients in Polymeric Passive Samplers: A Comparison of Simple Molecular and Quantum‐mechanical Sigma‐moment Descriptors
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800110
MUBD‐DecoyMaker 2.0: A Python GUI Application to Generate Maximal Unbiased Benchmarking Data Sets for Virtual Drug Screening
来源期刊:Molecular InformaticsDOI:10.1002/minf.201900151
Benserazide Perturbs Kif15‐kinesin Binding Protein Interaction with Prolonged Metaphase and Defects in Chromosomal Congression: A Study Based on in silico Modeling and Cell Culture
来源期刊:Molecular InformaticsDOI:10.1002/minf.201900035
Interpretation of QSAR Models: Mining Structural Patterns Taking into Account Molecular Context
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800084
Novel Electrotopological Atomic Descriptors for the Prediction of Xenobiotic Cytochrome P450 Reactions
来源期刊:Molecular InformaticsDOI:10.1002/minf.201900010
Tropical and Subtropical Parasitic Diseases: Targets for a New Approach to Virtual Screening
来源期刊:Molecular InformaticsDOI:10.1002/minf.201900052
Value of p‐Value
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800152
An in silico Approach for Integrating Phenotypic and Target‐based Approaches in Drug Discovery
来源期刊:Molecular InformaticsDOI:10.1002/minf.201900096
Computational Analysis of Non‐covalent Interactions in Phycocyanin Subunit Interfaces
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800145
Identification of the Apoptosis and Autophagy Bi‐functional Proteins
来源期刊:Molecular InformaticsDOI:10.1002/minf.201900008
QSAR Analysis of a Series of Hydantoin‐based Androgen Receptor Modulators and Corresponding Binding Affinities
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800147
Integration of Cancer Genomics Data for Tree‐based Dimensionality Reduction and Cancer Outcome Prediction
来源期刊:Molecular InformaticsDOI:10.1002/minf.201900028
Ambit‐GCM: An Open‐source Software Tool for Group Contribution Modelling
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800138
RadAA: A Command‐line Tool for Identification of Radical Amino Acid Changes in Multiple Sequence Alignments
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800057
Celebrating 40 Years of Career
来源期刊:Molecular InformaticsDOI:10.1002/minf.201980831
The Acid Strength of the Lewis‐Brønsted Superacids – A QSPR Study
来源期刊:Molecular InformaticsDOI:10.1002/minf.201800113

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