W. Andrzej Sokalski

发表

W. Andrzej Sokalski, Morris Krauss, 2000, Comput. Chem..

International conference and workshop: Modeling and Design of Molecular Materials (10–15 September 2006, Wrocław, Poland)

Jaroslav V. Burda, W. Andrzej Sokalski, Jerzy Leszczyński, 2007 .

International conference: Modeling & Design of Molecular Materials—MDMM 2012 (September 10–14, 2012, Wrocław, Poland)

W. Andrzej Sokalski, Jarosław V. Burda, 2013, Journal of Molecular Modeling.

The international workshop “Modeling & Design of Molecular Materials”, held 16–20 September 2004 in Wrocław

Jaroslav V. Burda, W. Andrzej Sokalski, 2005 .

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

W. Andrzej Sokalski, Pawel Kdzierski, 2001, J. Comput. Chem..

Evaluation of molecular Cartesian coordinates by a programmable calculator

W. Andrzej Sokalski, 1980, Comput. Chem..

The third conference on computers in chemistry 23–26 June 1994, Wroclaw, Poland including the workshop on computational methods for large molecular systems

W. Andrzej Sokalski, Morris Krauss, 1995 .

International conference: Modeling & Design of Molecular Materials - MDMM 2008 (23–28 June 2008, Piechowice, Poland)

W. Andrzej Sokalski, Jerzy Leszczyński, Jarosław V. Burda, 2009 .

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

W. Andrzej Sokalski, Morris Krauss, Pawel Kdzierski, 2000, J. Comput. Chem..

Preliminary Density Functional Calculations on the Formic Acid Dimer

W. Andrzej Sokalski, Henryk Chojnacki, Jan W. Andzelm, 1995, Comput. Chem..

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

W. Andrzej Sokalski, Wiktor Beker, Karol M. Langner, 2013, J. Comput. Chem..

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

Rebecca C. Wade, W. Andrzej Sokalski, Wiktoria Jedwabny, 2017, Journal of Computer-Aided Molecular Design.

Potential energy curves in complementary base pairs and in model hydrogen bonded systems

W. Andrzej Sokalski, Henryk Chojnacki, H. Chojnacki, 1981 .

Efficient techniques for the decomposition of intermolecular interaction energy at SCF level and beyond

W. Andrzej Sokalski, Szczepan Roszak, W. Sokalski, 1991 .

Intramolecular electrostatic interactions studied by cumulative atomic multipole moment expansion with improved convergence

W. Andrzej Sokalski, Krzysztof Strasburger, W. Sokalski, 1994 .

Cumulative multicenter multipole moment databases and their applications

W. Andrzej Sokalski, W. Sokalski, Andrzej Sawaryn, 1992 .

Cumulative atomic multipole representation of the molecular charge distribution and its basis set dependence

Raymond A. Poirier, W. Andrzej Sokalski, R. Poirier, 1983 .

AN EFFICIENT PROCEDURE FOR DECOMPOSITION OF THE SCF INTERACTION ENERGY INTO COMPONENTS WITH REDUCED BASIS SET DEPENDENCE

W. Andrzej Sokalski, Szczepan Roszak, W. Sokalski, 1988 .