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cirx and spore synthetic methodology databases using isis or isentris software better faster synthesis of novel compounds search by structure to identify promising starting…
zahoránszky‑kőhalmi et al j cheminform 2020 12:5 https:doiorg101186s13321‑020‑0409‑9 research article smartgraph: a network pharmacology investigation platform…
from little acorns to tall oaks- from boranes through organoboranes nobel lecture 8 december 1979 by herbert c brown department of chemistry purdue university west lafayette…
1 the beginnings of silacyclopropane chemistry seyferth, d. annarelli, d.c. jacs 1975, 97, 2273. ! the first simple silacyclopropane was synthesized in 1975. ! synthesis…
volum e 6 n um ber 7 2008 o rganic b iom olecular c hem istry pages 1129–1300 issn 1477-0520 wwwrscorgobc volume 6 number 7 7 april 2008 pages 1129–1300 full paper dean…
burger j cheminform 2015 7:35 doi 101186s13321-015-0085-3 review chemdoodle web components: html5 toolkit for chemical graphics interfaces and informatics melanie c burger12*…
meli and biggin j cheminform 2020 12:49 https:doiorg101186s13321-020-00455-2 software spyrmsd: symmetry-corrected rmsd calculations in python rocco meli* and philip c biggin…
burger j cheminform 2015 7:35 doi 101186s13321-015-0085-3 review chemdoodle web components: html5 toolkit for chemical graphics interfaces and informatics melanie c burger12*…
martínez et al. j cheminform 2015 7:39 doi 10.1186s13321-015-0092-4 software visual analytics in cheminformatics: user-supervised descriptor selection for qsar methods…
gonzález‑medina et al. j cheminform 2016 8:63 doi 10.1186s13321‑016‑0176‑9 methodology consensus diversity plots: a global diversity analysis of chemical libraries…
lewis et al. j cheminform 2015 7:36 doi 10.1186s13321-015-0090-6 software synergy maps: exploring compound combinations using network-based visualization richard lewis1 ,…
ruusmann et al. j cheminform 2015 7:32 doi 10.1186s13321-015-0082-6 database qsar databank repository: open and linked qualitative and quantitative structure–activity…
chung and park j cheminform 2015 7:57 doi 101186s13321-015-0106-2 research article accuracy enhancement in the estimation of molecular hydration free energies by implementing…
banerjee et al. j cheminform 2016 8:51 doi 10.1186s13321-016-0162-2 research article computational methods for prediction of in vitro effects of new chemical structures…
kim et al. j cheminform 2017 9:21 doi 10.1186s13321-017-0208-0 methodology the comparison of automated clustering algorithms for resampling representative conformer ensembles…
fair chemical structures in the journal of cheminformaticsletter to the editor fair chemical structures in the journal of cheminformatics emma l. schymanski1*
arshad et al j cheminform 2016 8:58 doi 101186s13321-016-0169-8 methodology multi-level meta-workflows: new concept for regularly occurring tasks in quantum chemistry junaid…
dong et al. j cheminform 2015 7:60 doi 10.1186s13321-015-0109-z software chemdes: an integrated web-based platform for molecular descriptor and fingerprint computation…
castillo et al j cheminform 2016 8:26 doi 101186s13321-016-0134-6 research article “ask ernö”: a self-learning tool for assignment and prediction of nuclear magnetic…
hatherley et al. j cheminform 2015 7:29 doi 10.1186s13321-015-0080-8 database sancdb: a south african natural compound database rowan hatherley1, david k brown1, thommas…