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Application

Discovery Studio 1.0 Materials Studio 0.9713234273017637 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06711597865768043 Amorphous Cell 0.2739867078535992 Blends 0.002620986614246934 CASTEP 0.3940840587849855 CDOCKER 0.1742020031826266 CHARMm 0.26443882804455676 COMPASS 0.36281943274361134 COMPASS III 0.0802209117289151 COSMObase 0.003369839932603201 COSMOconf 0.004025086586164935 COSMOmic 2.808199943836001E-4 COSMOperm 0.0014040999719180005 COSMOplex 2.808199943836001E-4 COSMOquick 0.0015913133015070674 COSMOtherm 0.062154825423570155 Cantera 0.0 Catalyst 0.12374801085837311 Classical Simulations 1.0 Conformers 0.001029673312739867 Crystallization 0.07507254516521576 DFTB Plus 0.005429186558082936 DMol3 0.176729383132079 DPD 0.002714593279041468 Discover 0.003931479921370402 Forcite 0.5317794626977441 GULP 0.023869699522606008 Kinetix 2.808199943836001E-4 LUDI 0.005148366563699335 LibDock 0.0717963118974071 LigandFit 0.006552466535617336 MCSS 8.424599831508003E-4 MODELER 0.19432743611345127 MesoDyn 0.0012168866423289339 Mesocite 0.003557053262192268 Mesoscale 0.006833286530000936 Modules 0.0 Morphology 0.01722362632219414 ONETEP 0.001029673312739867 Polymorph 0.001965739960685201 QMERA 1.8721332958906674E-4 QSAR 0.001029673312739867 Quantum Mechanics 0.5591126088177478 Reflex 0.05522793222877469 Reflex Plus 8.424599831508003E-4 Semi-empirical 0.007114106524384536 Sorption 0.05607039221192549 Synthia 0.001310493307123467 TURBOMOLE 5.616399887672002E-4 VAMP 0.001310493307123467 Visualization 0.8603388561265563 X-Cell 0.001310493307123467 ZDOCK 0.029766919404661613

Year

2021 0.06883416017009214 2022 0.1515768958185684 2023 0.35063784549964566 2024 0.7443302622253721 2025 1.0 2026 0.3765946137491141 2027 0.0

Keywords

target 1.0 potential 0.27795629820051415 docking 0.22421272493573266 visualization 0.21164042416452442 analysis 0.19139620822622108 between 0.1536793059125964 novel 0.10391227506426735 energy 0.08455173521850899 binding 0.07599614395886889 cell 0.06129498714652956 activity 0.05619376606683805 promising 0.05559125964010283 interaction 0.039644922879177376 stability 0.03454370179948586 synthesized 0.030205655526992288 experimental 0.027916131105398458 performance 0.02406008997429306 effective 0.021529562982005142 protein 0.02080655526992288 mechanism 0.020766388174807197 development 0.01915970437017995 including 0.015745501285347043 synthesis 0.014781491002570694 design 0.0030526992287917736 chemical 0.0
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