Polyaniline–water interactions: A theoretical investigation with the polarisable continuum model J Romanova, J Petrova, A Tadjer, N Gospodinova Synthetic metals 160 (9-10), 1050-1054, 2010 | 32 | 2010 |
Theoretical study on the emeraldine salt–impact of the computational protocol J Romanova, J Petrova, A Ivanova, A Tadjer, N Gospodinova Journal of Molecular Structure: THEOCHEM 954 (1-3), 36-44, 2010 | 28 | 2010 |
Theoretical study of the structure and electronic spectra of fully protonated emeraldine oligomers H Zhekova, A Tadjer, A Ivanova, J Petrova, N Gospodinova International Journal of Quantum Chemistry 107 (8), 1688-1706, 2007 | 28 | 2007 |
Fully doped oligomers of emeraldine salt: polaronic versus bipolaronic configuration JN Petrova, JR Romanova, GK Madjarova, AN Ivanova, AV Tadjer The Journal of Physical Chemistry B 115 (14), 3765-3776, 2011 | 26 | 2011 |
Absorption spectra of model single chains of conducting polyaniline J Petrova, J Romanova, G Madjarova, A Ivanova, A Tadjer The Journal of Physical Chemistry B 116 (22), 6543-6552, 2012 | 19 | 2012 |
Molecular simulation of the structure of folate and antifolates at physiological conditions J Petrova, G Gocheva, N Ivanova, S Iliev, B Atanasova, G Madjarova, ... Journal of Molecular Graphics and Modelling 87, 172-184, 2019 | 12 | 2019 |
Tautomerism in folic acid: Combined molecular modelling and NMR study G Gocheva, N Petkov, AG Luri, S Iliev, N Ivanova, J Petrova, Y Mitrev, ... Journal of Molecular Liquids 292, 111392, 2019 | 10 | 2019 |
Characteristics of a folate receptor-α anchored into a multilipid bilayer obtained from atomistic molecular dynamics simulations G Gocheva, N Ivanova, S Iliev, J Petrova, G Madjarova, A Ivanova Journal of Chemical Theory and Computation 16 (1), 749-764, 2019 | 8 | 2019 |
Initial stages of spontaneous binding of folate-based vectors to folate receptor-α observed by unbiased molecular dynamics EN Schaber, N Ivanova, S Iliev, J Petrova, G Gocheva, G Madjarova, ... The Journal of Physical Chemistry B 125 (28), 7598-7612, 2021 | 6 | 2021 |
Identification and computational characterization of isomers with cis and trans amide bonds in folate and its analogues S Iliev, G Gocheva, N Ivanova, B Atanasova, J Petrova, G Madjarova, ... Physical Chemistry Chemical Physics 20 (45), 28818-28831, 2018 | 5 | 2018 |
Density Functional Theory Assessment of the Environment Polarity Effect on Polyaniline–Water Coupling J Petrova, A Ivanova, A Tadjer The Journal of Physical Chemistry A 121 (33), 6327-6335, 2017 | 1 | 2017 |
P1001: MODULATION OF MUTANT CALRETICULIN-DRIVEN ONCOGENESIS IN MYELOPROLIFERATIVE NEOPLASMS BY CLASSICAL HLA GENES V Shivarov, G Tsvetkova, I Micheva, S Lesichkova, J Petrova, A Ivanova, ... HemaSphere 7 (S3), e4399399, 2023 | | 2023 |
Numerical Analysis of Chemical Reactions by Monte Carlo Simulation D Dankov, V Roussinov, M Velinova, J Petrova Union of Bulgarian Mathematicians, 2011 | | 2011 |
Influence of the Level of Protonation on the Geometry and the Electronic Structure of Emeraldine Oligomers J Petrova, J Romanova, G Madjarova, A Ivanova, A Tadjer, ... Advances in the Theory of Atomic and Molecular Systems: Dynamics …, 2009 | | 2009 |
Can folate and its derivatives be used as vectors for targeted drug delivery? G Gocheva, N Ivanova, J Petrova, S Iliev, EN Schaber, B Atanasova, ... Dear colleagues, students, PhD students, postdoctoral students and young …, 0 | | |
Estimation of the influence of environmental effects on the properties of conducting polyaniline-the presence of explicit water molecules J Petrova, A Tadjer, I Ciofini, C Adamo | | |