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Application

Discovery Studio 1.0 Materials Studio 0.49396951623591784 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06253489670575098 Amorphous Cell 0.14852037967615858 Blends 0.002233389168062535 CASTEP 0.344500279173646 CDOCKER 0.38190954773869346 CHARMm 0.4849246231155779 COMPASS 0.26549413735343386 COMPASS III 0.038525963149078725 COSMObase 0.0013958682300390843 COSMOconf 5.583472920156337E-4 COSMOmic 0.0 COSMOperm 2.7917364600781687E-4 COSMOplex 0.0 COSMOquick 0.0016750418760469012 COSMOtherm 0.0446677833612507 Catalyst 0.38023450586264657 Classical Simulations 0.9958123953098827 Conformers 8.375209380234506E-4 Crystallization 0.06560580681183696 DFTB Plus 0.004745951982132886 DMol3 0.17895030709101062 DPD 0.0030709101060859855 Discover 0.007537688442211055 Forcite 0.3573422668900056 GULP 0.012283640424343942 LUDI 0.018983807928531545 LibDock 0.13456169737576773 LigandFit 0.047459519821328865 MCSS 0.003908431044109436 MODELER 0.3740926856504746 MesoDyn 0.0016750418760469012 Mesocite 0.0033500837520938024 Mesoscale 0.006700167504187605 Morphology 0.010887772194304857 ONETEP 2.7917364600781687E-4 Polymorph 0.0016750418760469012 QMERA 0.0 QSAR 0.001954215522054718 Quantum Mechanics 0.513679508654383 Reflex 0.052763819095477386 Reflex Plus 2.7917364600781687E-4 Semi-empirical 0.006141820212171971 Sorption 0.02233389168062535 Synthia 0.0011166945840312675 TURBOMOLE 5.583472920156337E-4 VAMP 8.375209380234506E-4 Visualization 1.0 X-Cell 0.0011166945840312675 ZDOCK 0.04327191513121161

Year

2010 0.0028536485935589076 2011 0.036689767631471665 2012 0.044027721157766 2013 0.057480635955972276 2014 0.06930289441500204 2015 0.08153281695882593 2016 0.08275580921320831 2017 0.10640032613126783 2018 0.12759885854056258 2019 0.20831634732980026 2020 0.25642070933550754 2021 0.418263350998777 2022 0.5067264573991032 2023 0.6318793314309009 2024 1.0 2025 0.9253974724826742 2026 0.23033020790868325 2027 0.0

Keywords

novel 1.0 target 0.9638482222886167 potential 0.29708196394781394 docking 0.2935962553530525 visualization 0.18693357235335126 analysis 0.15456627825913755 synthesized 0.13942834379045912 activity 0.1172194004581217 synthesis 0.11522756697540086 binding 0.1004879992032666 compound 0.08863658998107758 between 0.08455333134149985 promising 0.07857783089333732 development 0.07638681406234439 design 0.06632805497460412 protein 0.04611094512498755 drug 0.04431829499053879 potent 0.039936261328552936 vitro 0.033761577532118316 inhibition 0.029777910566676627 cell 0.02141220993924908 effective 0.01563589283935863 treatment 0.006971417189522956 interaction 0.00537795040334628 stability 0.0
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