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Application

Discovery Studio 0.5182473776223776 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05236547490068617 Amorphous Cell 0.18941856265799928 Antibody 0.0 Blends 0.004333694474539545 CASTEP 0.6437342000722283 CDOCKER 0.1155651859877212 CHARMm 0.19808595160707837 COMPASS 0.3326110509209101 COMPASS III 0.017515348501263996 COSMObase 5.417118093174431E-4 COSMOconf 0.002527988443481401 COSMOmic 0.0012639942217407005 COSMOperm 0.0010834236186348862 COSMOplex 5.417118093174431E-4 COSMOquick 0.0019862766341639583 COSMOtherm 0.09678584326471651 Catalyst 0.13615023474178403 Classical Simulations 0.8885879378837125 Conformers 0.0030697002527988442 Crystallization 0.08866016612495485 DFTB Plus 0.005236547490068617 DMol3 0.3714337305886602 DPD 0.014987360057782593 Discover 0.045684362585771035 Forcite 0.35337667027807873 GULP 0.10707836764174793 Kinetix 0.0 LUDI 0.01119537739256049 LibDock 0.04297580353918382 LigandFit 0.024918743228602384 MCSS 0.0018057060310581437 MODELER 0.2087396171903214 MesoDyn 0.006861682918020947 Mesocite 0.005958829902491874 Mesoscale 0.024196460816179127 Morphology 0.022029613578909354 ONETEP 0.004694835680751174 Polymorph 0.004694835680751174 QMERA 1.8057060310581438E-4 QSAR 0.004333694474539545 Quantum Mechanics 1.0 Reflex 0.05976886962802456 Reflex Plus 0.00451426507764536 Semi-empirical 0.01155651859877212 Sorption 0.03810039725532683 Synthia 0.0027085590465872156 TURBOMOLE 0.0021668472372697724 VAMP 0.005597688696280245 Visualization 0.519501625135428 X-Cell 0.004694835680751174 ZDOCK 0.021307331166486095

Year

2000 0.0 2001 0.021725636250775917 2002 0.03041589075108628 2003 0.03227808814400993 2004 0.045934202358783364 2005 0.05462445685909373 2006 0.08131595282433271 2007 0.09248913718187461 2008 0.12787088764742396 2009 0.15145872129112353 2010 0.20546244568590938 2011 0.26567349472377405 2012 0.3022967101179392 2013 0.3469894475481068 2014 0.3581626319056487 2015 0.42954686530105524 2016 0.41092489137181876 2017 0.4649286157666046 2018 0.5394165114835506 2019 0.5729360645561763 2020 0.6461824953445066 2021 0.7653631284916201 2022 0.798261949099938 2023 0.861576660459342 2024 1.0 2025 0.7914338919925512 2026 0.234016139044072

Keywords

well 1.0 target 0.947544561658785 between 0.20683885049108766 experimental 0.16013095671153146 potential 0.15736631502364495 energy 0.12957439068752274 analysis 0.11633321207711896 docking 0.08883230265551109 visualization 0.08082939250636595 chemical 0.06453255729356129 novel 0.05863950527464533 interaction 0.05180065478355766 binding 0.049036013095671155 cell 0.035576573299381596 surface 0.03499454347035286 activity 0.02466351400509276 synthesized 0.018843215714805385 including 0.018552200800291015 mechanism 0.016660603855947618 higher 0.008439432520916697 promising 0.0050200072753728625 protein 0.0032011640596580574 applied 0.0024736267733721355 design 8.730447435431065E-4 stability 0.0
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