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Application

Discovery Studio 1.0 Materials Studio 0.9638337701235492 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0658171967492726 Amorphous Cell 0.2744055382763118 Blends 0.002508277315139962 CASTEP 0.380054178790007 CDOCKER 0.1708638507073342 CHARMm 0.26507474666399117 COMPASS 0.3561753787498746 COMPASS III 0.08277315139961874 COSMObase 0.0035115882411959464 COSMOconf 0.004213905889435136 COSMOmic 1.0033109260559848E-4 COSMOperm 0.0013043042038727803 COSMOplex 2.0066218521119696E-4 COSMOquick 0.0014046352964783787 COSMOtherm 0.06210494632286546 Cantera 0.0 Catalyst 0.12732015651650447 Classical Simulations 1.0 Conformers 7.023176482391894E-4 Crystallization 0.07414467743553728 DFTB Plus 0.005417879000702318 DMol3 0.1712651750777566 DPD 0.002307615129928765 Discover 0.0032105949633791514 Forcite 0.5291461824019263 GULP 0.02377846894752684 Kinetix 3.0099327781679544E-4 LUDI 0.00461523025985753 LibDock 0.0725393799538477 LigandFit 0.00591953446373031 MCSS 7.023176482391894E-4 MODELER 0.1901274204876091 MesoDyn 0.0010033109260559848 Mesocite 0.0035115882411959464 Mesoscale 0.006421189926758303 Modules 0.0 Morphology 0.01775860339119093 ONETEP 0.0010033109260559848 Polymorph 0.001906290759506371 QMERA 1.0033109260559848E-4 QSAR 0.0010033109260559848 Quantum Mechanics 0.5403832647737534 Reflex 0.05387779672920638 Reflex Plus 9.029798334503862E-4 Semi-empirical 0.007324169760208689 Sorption 0.05628574295174074 Synthia 0.0015049663890839772 TURBOMOLE 6.019865556335909E-4 VAMP 0.0016052974816895757 Visualization 0.8542189224440654 X-Cell 0.0013043042038727803 ZDOCK 0.030099327781679543

Year

2022 0.10454985479186835 2023 0.36627651148464313 2024 0.627475138607762 2025 1.0 2026 0.37410895010120565 2027 0.0

Keywords

target 1.0 potential 0.28522306855277474 docking 0.23007616974972797 visualization 0.2134929270946681 analysis 0.1960391730141458 between 0.15307943416757344 novel 0.1042872687704026 energy 0.0847442872687704 binding 0.07795429815016322 cell 0.06224156692056583 promising 0.06071817192600653 activity 0.05749727965179543 interaction 0.038476605005440694 stability 0.037823721436343855 synthesized 0.03212187159956474 experimental 0.02842219804134929 performance 0.027290533188248096 protein 0.023939064200217627 effective 0.021414581066376497 development 0.021284004352557128 mechanism 0.020848748639825897 including 0.0181936887921654 synthesis 0.015538628944504897 design 0.0036126224156692054 chemical 0.0
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