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1

Numerical calculation of molecular surface area. I. Assessment of errors

Bliznyuk, Andrey A., Gready, Jill E.

Journal:

Journal of Computational Chemistry

Year:

1996

Language:

english

File:

PDF, 681 KB

english, 1996

2

Numerical calculation of molecular surface area. II. Speed of calculation

Bliznyuk, Andrey A., Gready, Jill E.

Journal:

Journal of Computational Chemistry

Year:

1996

Language:

english

File:

PDF, 562 KB

english, 1996

3

[IEEE 2016 57th International Scientific Conference on Power and Electrical Engineering of Riga Technical University (RTUCON) - Riga, Latvia (2016.10.13-2016.10.14)] 2016 57th International Scientific Conference on Power and Electrical Engineering of Riga Technical University (RTUCON) - Defining the equivalent inertia constant of generating unit based on electromechanical transient measurements

Bliznyuk, Dmitry, Berdin, Alexander, Gerasimov, Andrey

Year:

2016

Language:

english

File:

PDF, 431 KB

english, 2016

4

Faster gradients for semiempirical methods

Bliznyuk, Andrey A., Rendell, Alistair P.

Journal:

Journal of Computational Chemistry

Year:

1999

Language:

english

File:

PDF, 150 KB

english, 1999

5

Simple method for locating possible ligand binding sites on protein surfaces

Bliznyuk, Andrey A., Gready, Jill E.

Journal:

Journal of Computational Chemistry

Year:

1999

Language:

english

File:

PDF, 146 KB

english, 1999

6

Solvent Simulation

Peter L. Cummins, Andrey A. Bliznyuk, Jill E. Gready

Journal:

Year:

2004

File:

PDF, 48 KB

2004

7

Comparison of linear-scaling semiempirical methods and combined quantum mechanical/molecular mechanical methods for enzymic reactions. II. An energy decomposition analysis

Stephen J. Titmuss, Peter L. Cummins, Alistair P. Rendell, Andrey A. Bliznyuk, Jill E. Gready

Journal:

Journal of Computational Chemistry

Year:

2002

Language:

english

File:

PDF, 182 KB

english, 2002

8

Combining docking and molecular dynamic simulations in drug design

Hernán Alonso, Andrey A. Bliznyuk, Jill E. Gready

Journal:

Medicinal Research Reviews

Year:

2006

Language:

english

File:

PDF, 894 KB

english, 2006

9

Comparison of linear-scaling semiempirical methods and combined quantum mechanical/molecular mechanical methods applied to enzyme reactions

Stephen J Titmuss, Peter L Cummins, Andrey A Bliznyuk, Alistair P Rendell, Jill E Gready

Journal:

Chemical Physics Letters

Year:

2000

Language:

english

File:

PDF, 297 KB

english, 2000

10

Comparison of semiempirical and ab initio QM decomposition analyses for the interaction energy between molecules

Peter L Cummins, Stephen J Titmuss, Dylan Jayatilaka, Andrey A Bliznyuk, Alistair P Rendell, Jill E Gready

Journal:

Chemical Physics Letters

Year:

2002

Language:

english

File:

PDF, 88 KB

english, 2002

11

Computational chemistry on Fujitsu vector–parallel processors: Development and performance of applications software

Alistair P. Rendell, Andrey Bliznyuk, Thomas Huber, Ross H. Nobes, Elena V. Akhmatskaya, Herbert A. Früchtl, Paul W.-C. Kung, Victor Milman, Han Lung

Journal:

Parallel Computing

Year:

2000

Language:

english

File:

PDF, 517 KB

english, 2000

12

MNDO calculations of systems containing hydrogen bonds

Alexander A. Voityuk, Andrey A. Bliznyuk

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Year:

1987

Language:

english

File:

PDF, 256 KB

english, 1987

13

Multiple ligand-binding modes in bacterial R67 dihydrofolate reductase

Hernán Alonso, Malcolm B. Gillies, Peter L. Cummins, Andrey A. Bliznyuk, Jill E. Gready

Journal:

Journal of Computer-Aided Molecular Design

Year:

2005

Language:

english

File:

PDF, 798 KB

english, 2005

14

The dodecahedral N20 molecule. Some theoretical predictions

Andrey A. Bliznyuk, Mingzuo Shen, Henry F. Schaefer III

Journal:

Chemical Physics Letters

Year:

1992

Language:

english

File:

PDF, 316 KB

english, 1992

15

Identification and energetic ranking of possible docking sites for pterin on dihydrofolate reductase

Andrey A. Bliznyuk, Jill E. Gready

Journal:

Journal of Computer-Aided Molecular Design

Year:

1998

Language:

english

File:

PDF, 101 KB

english, 1998

16

Proton affinities of lysine and histidine: a theoretical consideration of the discrepancy between experimental results from the kinetic and bracketing methods

Bliznyuk, Andrey A., Schaefer, Henry F., Amster, I. Jonathan

Journal:

Journal of the American Chemical Society

Year:

1993

Language:

english

File:

PDF, 661 KB

english, 1993

17

The Potassium Ion Channel: Comparison of Linear Scaling Semiempirical and Molecular Mechanics Representations of the Electrostatic Potential

Bliznyuk, Andrey A., Rendell, Alistair P., Allen, Toby W., Chung, Shin-Ho

Journal:

Journal of Physical Chemistry B

Year:

2001

Language:

english

File:

PDF, 98 KB

english, 2001

18

Charge Transfer Effects in the GroEL–GroES Chaperonin Tetramer in Solution

Anisimov, Victor M., Bliznyuk, Andrey A.

Journal:

Journal of Physical Chemistry B

Year:

2012

Language:

english

File:

PDF, 3.76 MB

english, 2012

19

Comparison of electrostatic potential around proteins calculated from Amber and AM1 charges: application to mutants of prion protein

ZUEGG, JOHANNES, BLIZNYUK, ANDREY A., GREADY, JILL E.

Journal:

Molecular Physics

Year:

2003

Language:

english

File:

PDF, 1.06 MB

english, 2003

20

[IEEE 2011 International Conference on Collaboration Technologies and Systems (CTS) - Philadelphia, PA, USA (2011.05.23-2011.05.27)] 2011 International Conference on Collaboration Technologies and Systems (CTS) - Green Daily Guide. Easier environmentally friendly transportation with the help of mobile technologies

Bliznyuk, Andrey

Year:

2011

Language:

english

File:

PDF, 510 KB

english, 2011

21

A New Approach to Estimation of the Electrostatic Component of the Solvation Energy in Molecular Mechanics Calculations

Bliznyuk, Andrey A., Gready, Jill E.

Journal:

Journal of Physical Chemistry

Year:

1995

Language:

english

File:

PDF, 831 KB

english, 1995

22

[IEEE 2016 International Conference and Exposition on Electrical and Power Engineering (EPE) - Iasi, Romania (2016.10.20-2016.10.22)] 2016 International Conference and Exposition on Electrical and Power Engineering (EPE) - The problems of dissolved in oil gases analysis results' interpretation in information analytical systems

Khalyasmaa, Alexandra I., Bliznyuk, Dmitry I., Verkhozin, Andrey M., Ovchinnikov, Konstantin V.

Year:

2016

Language:

english

File:

PDF, 1024 KB

english, 2016

23

[IEEE 2017 9th International Conference on Information Technology and Electrical Engineering (ICITEE) - Phuket (2017.10.12-2017.10.13)] 2017 9th International Conference on Information Technology and Electrical Engineering (ICITEE) - Defining the damping properties of synchronous generator using disturbance measurements

Bliznyuk, Dmitry, Berdin, Alexander, Kovalenko, Pavel, Dekhtiar, Sergei, Gerasimov, Andrey

Year:

2017

Language:

english

File:

PDF, 451 KB

english, 2017

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