Gregory A. Bakken

1.2k total citations · 1 hit paper
18 papers, 900 citations indexed

About

Gregory A. Bakken is a scholar working on Computational Theory and Mathematics, Materials Chemistry and Analytical Chemistry. According to data from OpenAlex, Gregory A. Bakken has authored 18 papers receiving a total of 900 indexed citations (citations by other indexed papers that have themselves been cited), including 10 papers in Computational Theory and Mathematics, 6 papers in Materials Chemistry and 5 papers in Analytical Chemistry. Recurrent topics in Gregory A. Bakken's work include Computational Drug Discovery Methods (10 papers), Machine Learning in Materials Science (5 papers) and Analytical Chemistry and Chromatography (4 papers). Gregory A. Bakken is often cited by papers focused on Computational Drug Discovery Methods (10 papers), Machine Learning in Materials Science (5 papers) and Analytical Chemistry and Chromatography (4 papers). Gregory A. Bakken collaborates with scholars based in United States and United Kingdom. Gregory A. Bakken's co-authors include P. C. Jurs, Peter C. Jurs, K. Brajesh, John H. Kalivas, Franco Lombardo, Ray Unwalla, Frank M. DiCapua, Michael D. Miller, Meihua Tu and David M. Potter and has published in prestigious journals such as Chemical Reviews, Journal of Medicinal Chemistry and Analytica Chimica Acta.

In The Last Decade

Gregory A. Bakken

18 papers receiving 878 citations

Hit Papers

align trajectories

What are hit papers?

Hit papers significantly outperform the citation benchmark for their cohort. A paper qualifies if it has ≥500 total citations, achieves ≥1.5× the top-1% citation threshold for papers in the same subfield and year (this is the minimum needed to enter the top 1%, not the average within it), or reaches the top citation threshold in at least one of its specific research topics.

Computational Methods for the Analysis of Chemical Sensor Array Data from Volatile Analytes

2000 485 citations P. C. Jurs, Gregory A. Bakken et al. Chemical Reviews profile →

Peers

Gregory A. Bakken

CTM

SPECT

Chau My Du United Kingdom

Patrick Gaillard Switzerland

Zahra Garkani‐Nejad Iran

Bing Jin China

Mark F. Vitha United States

Takahiro Suzuki Japan

Reinhard Meusinger Germany

Björn C. G. Karlsson Sweden

Markéta Paloncýová Czechia

Chau My Du United Kingdom

Gregory A. Bakken

207 ×0.5

163 ×0.6

120 ×0.5

CTM

434 ×1.9

SPECT

130 ×0.7

Citations per year, relative to Gregory A. Bakken Gregory A. Bakken (= 1×) peers Chau My Du

Countries citing papers authored by Gregory A. Bakken

Since Specialization

Citations

This map shows the geographic impact of Gregory A. Bakken's research. It shows the number of citations coming from papers published by authors working in each country. You can also color the map by specialization and compare the number of citations received by Gregory A. Bakken with the expected number of citations based on a country's size and research output (numbers larger than one mean the country cites Gregory A. Bakken more than expected).

Fields of papers citing papers by Gregory A. Bakken

Since Specialization

Physical SciencesHealth SciencesLife SciencesSocial Sciences

This network shows the impact of papers produced by Gregory A. Bakken. Nodes represent research fields, and links connect fields that are likely to share authors. Colored nodes show fields that tend to cite the papers produced by Gregory A. Bakken. The network helps show where Gregory A. Bakken may publish in the future.

Co-authorship network of co-authors of Gregory A. Bakken

This figure shows the co-authorship network connecting the top 25 collaborators of Gregory A. Bakken. A scholar is included among the top collaborators of Gregory A. Bakken based on the total number of citations received by their joint publications. Widths of edges represent the number of papers authors have co-authored together. Node borders signify the number of papers an author published with Gregory A. Bakken. Gregory A. Bakken is excluded from the visualization to improve readability, since they are connected to all nodes in the network.

All Works

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18 of 18 papers shown

Brajesh, K., Vishnu Sresht, Qingyi Yang, et al.. (2022). TorsionNet: A Deep Neural Network to Rapidly Predict Small-Molecule Torsional Energy Profiles with the Accuracy of Quantum Mechanics. Journal of Chemical Information and Modeling. 62(4). 785–800. 32 indexed citations

Brajesh, K., Vishnu Sresht, Qingyi Yang, et al.. (2019). Comprehensive Assessment of Torsional Strain in Crystal Structures of Small Molecules and Protein–Ligand Complexes using ab Initio Calculations. Journal of Chemical Information and Modeling. 59(10). 4195–4208. 23 indexed citations

Brajesh, K. & Gregory A. Bakken. (2013). Fast and accurate generation of ab initio quality atomic charges using nonparametric statistical regression. Journal of Computational Chemistry. 34(19). 1661–1671. 43 indexed citations

Zhu, Hongyao, Jacquelyn Klug‐McLeod, & Gregory A. Bakken. (2013). A Heuristic Algorithm for Plate SelectionThat Maximizes Compound Diversity. Croatica Chemica Acta. 86(4). 435–441. 3 indexed citations

Bakken, Gregory A., Andrew Bell, Markus Boehm, et al.. (2012). Shaping a Screening File for Maximal Lead Discovery Efficiency and Effectiveness: Elimination of Molecular Redundancy. Journal of Chemical Information and Modeling. 52(11). 2937–2949. 27 indexed citations

Withka, Jane M., David Hepworth, Thomas V. Magee, et al.. (2011). Design of a multi-purpose fragment screening library using molecular complexity and orthogonal diversity metrics. Journal of Computer-Aided Molecular Design. 25(7). 621–636. 38 indexed citations

Yu, Ning & Gregory A. Bakken. (2009). Efficient Exploration of Large Combinatorial Chemistry Spaces by Monomer-Based Similarity Searching. Journal of Chemical Information and Modeling. 49(4). 745–755. 12 indexed citations

Lombardo, Franco, R. Scott Obach, Frank M. DiCapua, et al.. (2006). A Hybrid Mixture Discriminant Analysis−Random Forest Computational Model for the Prediction of Volume of Distribution of Drugs in Human. Journal of Medicinal Chemistry. 49(7). 2262–2267. 74 indexed citations

Bakken, Gregory A., Gregory W. Kauffman, Peter C. Jurs, Keith J. Albert, & Shannon E. Stitzel. (2001). Pattern recognition analysis of optical sensor array data to detect nitroaromatic compound vapors. Sensors and Actuators B Chemical. 79(1). 1–10. 28 indexed citations

10.

Bakken, Gregory A. & Peter C. Jurs. (2001). QSARs for 6-Azasteroids as Inhibitors of Human Type 1 5α-Reductase: Prediction of Binding Affinity and Selectivity Relative to 3-BHSD. Journal of Chemical Information and Computer Sciences. 41(5). 1255–1265. 11 indexed citations

11.

Jurs, P. C., et al.. (2000). Computational Methods for the Analysis of Chemical Sensor Array Data from Volatile Analytes. Chemical Reviews. 100(7). 2649–2678. 485 indexed citations breakdown →

12.

Bakken, Gregory A. & Peter C. Jurs. (2000). Classification of Multidrug-Resistance Reversal Agents Using Structure-Based Descriptors and Linear Discriminant Analysis. Journal of Medicinal Chemistry. 43(23). 4534–4541. 61 indexed citations

13.

Bakken, Gregory A. & Peter C. Jurs. (1999). Prediction of Methyl Radical Addition Rate Constants from Molecular Structure. Journal of Chemical Information and Computer Sciences. 39(3). 508–514. 4 indexed citations

14.

Bakken, Gregory A. & Peter C. Jurs. (1999). Prediction of Hydroxyl Radical Rate Constants from Molecular Structure. Journal of Chemical Information and Computer Sciences. 39(6). 1064–1075. 28 indexed citations

15.

Bakken, Gregory A., et al.. (1999). Cyclic subspace regression with analysis of wavelength-selection criteria. Chemometrics and Intelligent Laboratory Systems. 45(1-2). 225–239. 13 indexed citations

16.

Bakken, Gregory A., et al.. (1997). Examination of Criteria for Local Model Principal Component Regression. Applied Spectroscopy. 51(12). 1814–1822. 5 indexed citations

17.

Bakken, Gregory A., et al.. (1996). Determination of componentwise chromatographic elution regions using singular value evolving profiles. Analytica Chimica Acta. 334(1-2). 15–25. 1 indexed citations

18.

Bakken, Gregory A. & John H. Kalivas. (1995). Assessing chromatographic peak purity using condition index and singular value evolving profiles. Analytica Chimica Acta. 300(1-3). 173–181. 12 indexed citations

Rankless uses publication and citation data sourced from OpenAlex, an open and comprehensive bibliographic database. While OpenAlex provides broad and valuable coverage of the global research landscape, it—like all bibliographic datasets—has inherent limitations. These include incomplete records, variations in author disambiguation, differences in journal indexing, and delays in data updates. As a result, some metrics and network relationships displayed in Rankless may not fully capture the entirety of a scholar's output or impact.

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