Piotr Dittwald
Overview
Explore the profile of Piotr Dittwald including associated specialties, affiliations and a list of published articles.
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Articles
19
Citations
508
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0
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Recent Articles
1.
Mikulak-Klucznik B, Golebiowska P, Bayly A, Popik O, Klucznik T, Szymkuc S, et al.
Nature
. 2020 Oct;
588(7836):83-88.
PMID: 33049755
Training algorithms to computationally plan multistep organic syntheses has been a challenge for more than 50 years. However, the field has progressed greatly since the development of early programs such...
2.
Szymkuc S, Gajewska E, Molga K, Wolos A, Roszak R, Beker W, et al.
Chem Sci
. 2020 Oct;
11(26):6736-6744.
PMID: 33033595
A computer program for retrosynthetic planning helps develop multiple "synthetic contingency" plans for hydroxychloroquine and also routes leading to remdesivir, both promising but yet unproven medications against COVID-19. These plans...
3.
Molga K, Dittwald P, Grzybowski B
Chem Sci
. 2020 Feb;
10(40):9219-9232.
PMID: 32055308
Although computer programs for retrosynthetic planning have shown improved and in some cases quite satisfactory performance in designing routes leading to specific, individual targets, no algorithms capable of planning syntheses...
4.
Lermyte F, Dittwald P, Claesen J, Baggerman G, Sobott F, OConnor P, et al.
Anal Chem
. 2019 Jul;
91(15):10310-10319.
PMID: 31283196
Top-down proteomics approaches are becoming ever more popular, due to the advantages offered by knowledge of the intact protein mass in correctly identifying the various proteoforms that potentially arise due...
5.
Bajczyk M, Dittwald P, Wolos A, Szymkuc S, Grzybowski B
Angew Chem Int Ed Engl
. 2018 Feb;
57(9):2367-2371.
PMID: 29405528
Analysis of the chemical-organic knowledge represented as a giant network reveals that it contains millions of reaction sequences closing into cycles. Without realizing it, independent chemists working at different times...
6.
Szymkuc S, Gajewska E, Klucznik T, Molga K, Dittwald P, Startek M, et al.
Angew Chem Int Ed Engl
. 2016 Apr;
55(20):5904-37.
PMID: 27062365
Exactly half a century has passed since the launch of the first documented research project (1965 Dendral) on computer-assisted organic synthesis. Many more programs were created in the 1970s and...
7.
Dittwald P, Valkenborg D, Claesen J, Rockwood A, Gambin A
J Am Soc Mass Spectrom
. 2015 Aug;
26(10):1732-45.
PMID: 26265039
Mass spectrometry enables the study of increasingly larger biomolecules with increasingly higher resolution, which is able to distinguish between fine isotopic variants having the same additional nucleon count, but slightly...
8.
Emami F, Vahid A, Wylie E, Szymkuc S, Dittwald P, Molga K, et al.
Angew Chem Int Ed Engl
. 2015 Jul;
54(37):10797-801.
PMID: 26215084
A thermodynamically guided calculation of free energies of substrate and product molecules allows for the estimation of the yields of organic reactions. The non-ideality of the system and the solvent...
9.
Dittwald P, Nghia V, Harris G, Caprioli R, Van de Plas R, Laukens K, et al.
EuPA Open Proteom
. 2014 Nov;
4:87-100.
PMID: 25414814
Although physicochemical fractionation techniques play a crucial role in the analysis of complex mixtures, they are not necessarily the best solution to separate specific molecular classes, such as lipids and...
10.
Campbell I, Gambin T, Dittwald P, Beck C, Shuvarikov A, Hixson P, et al.
BMC Biol
. 2014 Sep;
12:74.
PMID: 25246103
Background: Recurrent rearrangements of the human genome resulting in disease or variation are mainly mediated by non-allelic homologous recombination (NAHR) between low-copy repeats. However, other genomic structures, including AT-rich palindromes...