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Application

Discovery Studio 1.0 Materials Studio 0.9598773066838173 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06712611991729842 Amorphous Cell 0.2738800827015851 Antibody 2.756719503790489E-4 Blends 0.003032391454169538 CASTEP 0.41612680909717437 CDOCKER 0.183184011026878 CHARMm 0.26271536871123363 COMPASS 0.374776016540317 COMPASS III 0.06981392143349414 COSMObase 0.0026878015161957273 COSMOconf 0.0031013094417643005 COSMOmic 2.067539627842867E-4 COSMOperm 0.001171605789110958 COSMOplex 3.4458993797381116E-4 COSMOquick 0.0016540317022742937 COSMOtherm 0.0642315644383184 Cantera 6.891798759476223E-5 Catalyst 0.1186078566505858 Classical Simulations 1.0 Conformers 0.0014472777394900068 Crystallization 0.07594762232942798 DFTB Plus 0.005926946933149552 DMol3 0.19262577532736044 DPD 0.0033080634045485873 Discover 0.005306685044796692 Forcite 0.5289455547898001 GULP 0.027636113025499655 Kinetix 2.067539627842867E-4 LUDI 0.006271536871123363 LibDock 0.0724328049620951 LigandFit 0.009372846312887664 MCSS 0.001791867677463818 MODELER 0.1994486560992419 MesoDyn 0.001791867677463818 Mesocite 0.004479669193659545 Mesoscale 0.008270158511371467 Modules 0.0 Morphology 0.017849758787043417 ONETEP 0.0012405237767057202 Polymorph 0.0018607856650585803 QMERA 2.756719503790489E-4 QSAR 0.001516195727084769 Quantum Mechanics 0.5959338387319091 Reflex 0.05603032391454169 Reflex Plus 6.891798759476223E-4 Semi-empirical 0.00806340454858718 Sorption 0.05354927636113026 Synthia 0.0013783597518952446 TURBOMOLE 5.513439007580978E-4 VAMP 0.0017229496898690559 Visualization 0.9027567195037904 X-Cell 0.001171605789110958 ZDOCK 0.03128876636802205

Year

2019 0.0 2020 0.1396232789931582 2021 0.26049497423768897 2022 0.29470394458991467 2023 0.5662640425711631 2024 1.0 2025 0.966889095362784 2026 0.3599121547427992 2027 8.446659346228566E-4

Keywords

target 1.0 potential 0.2505427951091304 visualization 0.21428979545194834 docking 0.21177579705176552 analysis 0.16978059650325678 between 0.149468632156325 novel 0.0984458918980688 energy 0.07776254142383728 binding 0.0673351616958062 cell 0.054250942749400066 activity 0.05207976231287853 interaction 0.03893840703919552 promising 0.03759570334818878 synthesized 0.02593989258370472 experimental 0.025339961147297453 stability 0.019512055765055422 protein 0.019369214946863215 mechanism 0.016483830419380643 development 0.012912809964575478 effective 0.012227174037252885 synthesis 0.01079876585533082 performance 0.007713404182379157 including 0.002485430236544395 chemical 0.0020283396183293336 design 0.0
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