| Generalized Born model: Analysis, refinement, and applications to proteins M Wojciechowski, B Lesyng The Journal of Physical Chemistry B 108 (47), 18368-18376, 2004 | 142 | 2004 |
| Quantum-classical molecular dynamics simulations of proton transfer processes in molecular complexes and in enzymes P Bała, P Grochowski, B Lesyng, JA McCammon The Journal of Physical Chemistry 100 (7), 2535-2545, 1996 | 115 | 1996 |
| A comparative study of time dependent quantum mechanical wave packet evolution methods TN Truong, JJ Tanner, P Bala, JA McCammon, DJ Kouri, B Lesyng, ... The Journal of chemical physics 96 (3), 2077-2084, 1992 | 107 | 1992 |
| Dipole moments of 2, 4-diketopyrimidines: Part II: Uracil, thymine and their derivatives I Kulakowska, M Geller, B Lesyng, KL Wierzchowski Biochimica et Biophysica Acta (BBA)-Nucleic Acids and Protein Synthesis 361 …, 1974 | 94 | 1974 |
| Ab initio study of proton transfer in [H3N− H− NH3]+ and [H3N− H− OH2]+ L Jaroszewski, B Lesyng, JJ Tanner, JA McCammon Chemical physics letters 175 (4), 282-288, 1990 | 93 | 1990 |
| Efficacy of 2-halogen substituted d-glucose analogs in blocking glycolysis and killing “hypoxic tumor cells” TJ Lampidis, M Kurtoglu, JC Maher, H Liu, A Krishan, V Sheft, ... Cancer chemotherapy and pharmacology 58, 725-734, 2006 | 86 | 2006 |
| Cooperative effects in extended hydrogen bonded systems involving OH groups. Ab initio studies of the cyclic S4 water tetramer JEH Koehler, W Saenger, B Lesyng Journal of computational chemistry 8 (8), 1090-1098, 1987 | 81 | 1987 |
| Structural basis of oncogenic activation caused by point mutations in the kinase domain of the MET proto‐oncogene: Modeling studies M Miller, K Ginalski, B Lesyng, N Nakaigawa, L Schmidt, B Zbar Proteins: Structure, Function, and Bioinformatics 44 (1), 32-43, 2001 | 79 | 2001 |
| Applications of quantum-classical and quantum-stochastic molecular dynamics simulations for proton transfer processes P Bala, B Lesyng, JA McCammon Chemical physics 180 (2-3), 271-285, 1994 | 77 | 1994 |
| Class IV charge model for the self-consistent charge density-functional tight-binding method JA Kalinowski, B Lesyng, JD Thompson, CJ Cramer, DG Truhlar The Journal of Physical Chemistry A 108 (13), 2545-2549, 2004 | 75 | 2004 |
| Density functional based parametrization of a valence bond method and its applications in quantum‐classical molecular dynamics simulations of enzymatic reactions P Grochowski, B Lesyng, P Bała, JA McCammon International journal of quantum chemistry 60 (6), 1143-1164, 1996 | 68 | 1996 |
| Structure-based sequence alignment for the β-trefoil subdomain of the clostridial neurotoxin family provides residue level information about the putative ganglioside binding site K Ginalski, C Venclovas, B Lesyng, K Fidelis FEBS letters 482 (1-2), 119-124, 2000 | 63 | 2000 |
| Molecular and electrostatic properties of the N-methylated nucleic acid bases by density functional theory G Bakalarski, P Grochowski, JS Kwiatkowski, B Lesyng, J Leszczyński Chemical physics 204 (2-3), 301-311, 1996 | 61 | 1996 |
| Tautomerism of pyrimidine bases—uracil, cytosine, isocytosine: Theoretical study with complete optimization of geometry R Czermiński, B Lesyng, A Pohorille International journal of quantum chemistry 16 (3), 605-613, 1979 | 61 | 1979 |
| Barrier to rotation and conformation of the-NR2 group in cytosine and its derivatives. Part II. Experimental and theoretical dipole moments of methylated cytosines I Kulakowska, M Geller, B Lesyng, K Bolewska, KL Wierzchowski Biochimica et Biophysica Acta (BBA)-Nucleic Acids and Protein Synthesis 407 …, 1975 | 58 | 1975 |
| Surface markers of cancer stem-like cells of ovarian cancer and their clinical relevance A Klemba, JK Purzycka-Olewiecka, G Wcisło, AM Czarnecka, S Lewicki, ... Contemporary Oncology/Współczesna Onkologia 2018 (1), 48-55, 2018 | 57 | 2018 |
| Adding numbers with DNA P Wasiewicz, JJ Mulawka, WR Rudnicki, B Lesyng Smc 2000 conference proceedings. 2000 ieee international conference on …, 2000 | 55 | 2000 |
| Extended Hellmann-Feynman theorem for non-stationary states and its application in quantum-classical molecular dynamics simulations P Bala, B Lesyng, JA McCammon Chemical physics letters 219 (3-4), 259-266, 1994 | 55 | 1994 |
| Vibrations and hydrogen bonding in porphycene S Gawinkowski, Ł Walewski, A Vdovin, A Slenczka, S Rols, MR Johnson, ... Physical Chemistry Chemical Physics 14 (16), 5489-5503, 2012 | 54 | 2012 |
| Molecular modeling methods. Basic techniques and challenging problems B Lesyng, JA McCammon Pharmacology & therapeutics 60 (2), 149-167, 1993 | 48 | 1993 |
Prof. J. Andrew McCammonUniversity of California, San DiegoGeverifieerd e-mailadres voor ucsd.edu
