W. Andrzej Sokalski

According to our database, W. Andrzej Sokalski authored at least 9 papers between 1980 and 2017.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of five.

2017

Application of a simple quantum chemical approach to ligand fragment scoring for Trypanosoma brucei pteridine reductase 1 inhibition.

Wiktoria Jedwabny, Joanna Panecka-Hofman, Edyta Dyguda-Kazimierowicz, Rebecca C. Wade, W. Andrzej Sokalski

J. Comput. Aided Mol. Des., 2017

2013

Low cost prediction of relative stabilities of hydrogen bonded complexes from atomic multipole moments for overly short intermolecular distances.

Wiktor Beker, Karol M. Langner, Edyta Dyguda-Kazimierowicz, Mikolaj Feliks, W. Andrzej Sokalski

J. Comput. Chem., 2013

2001

Analysis of the transferability of atomic multipoles for amino acids in modeling macromolecular charge distribution from fragments.

Pawel Kdzierski, W. Andrzej Sokalski

J. Comput. Chem., 2001

2000

Nonempirical analysis of nature of catalytic effects in ribonuclease A active site.

Pawel Kdzierski, W. Andrzej Sokalski, Morris Krauss

J. Comput. Chem., 2000

Computer-aided design and activity prediction of leucine aminopeptidase inhibitors.

J. Grembecka, W. Andrzej Sokalski, P. Kafarski

J. Comput. Aided Mol. Des., 2000

Preface.

W. Andrzej Sokalski, Morris Krauss

Comput. Chem., 2000

1995

Preliminary Density Functional Calculations on the Formic Acid Dimer.

Henryk Chojnacki, Jan W. Andzelm, T. Nguyen Dzung, W. Andrzej Sokalski

Comput. Chem., 1995

1993

Multipole correction of atomic monopole models of molecular charge distribution. I. Peptides.

W. Andrzej Sokalski, D. A. Keller, Rick L. Ornstein, R. Rein

J. Comput. Chem., 1993

1980

Evaluation of molecular Cartesian coordinates by a programmable calculator.

W. Andrzej Sokalski

Comput. Chem., 1980