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Application

Discovery Studio 0.8528566162919278 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06992937431612455 Amorphous Cell 0.2874763752113797 Blends 0.0026857654431512983 CASTEP 0.3979906495573461 CDOCKER 0.1476176265791306 CHARMm 0.23435790311349847 COMPASS 0.3744155973341291 COMPASS III 0.08485029344474286 COSMObase 0.0035810205908683975 COSMOconf 0.0041778573560131305 COSMOmic 9.947279419078882E-5 COSMOperm 0.0012931463244802547 COSMOplex 1.9894558838157763E-4 COSMOquick 0.0013926191186710434 COSMOtherm 0.06396100666467722 Cantera 0.0 Catalyst 0.10633641698995325 Classical Simulations 1.0 Conformers 8.952551477170994E-4 Crystallization 0.07768825226300607 DFTB Plus 0.005769422063065751 DMol3 0.18074206704466328 DPD 0.0027852382373420867 Discover 0.003282602208296031 Forcite 0.5524718989356411 GULP 0.02447030737093405 Kinetix 2.984183825723665E-4 LUDI 0.0036804933850591863 LibDock 0.06296627872276932 LigandFit 0.004575748532776286 MCSS 4.973639709539441E-4 MODELER 0.1805431214562817 MesoDyn 0.001094200736098677 Mesocite 0.004078384561822341 Mesoscale 0.0070625683875460065 Modules 0.0 Morphology 0.01850193971948672 ONETEP 9.947279419078882E-4 Polymorph 0.0018899830896249876 QMERA 1.9894558838157763E-4 QSAR 0.001094200736098677 Quantum Mechanics 0.567591763652641 Reflex 0.056699492688749624 Reflex Plus 8.952551477170994E-4 Semi-empirical 0.007758877946881528 Sorption 0.057594747836466724 Synthia 0.0014920919128618322 TURBOMOLE 5.96836765144733E-4 VAMP 0.001591564707052621 Visualization 0.7424649358400478 X-Cell 0.0012931463244802547 ZDOCK 0.025166616930269572

Year

2022 7.028024246683651E-4 2023 0.31520688746376174 2024 0.6887463761749978 2025 1.0 2026 0.3734516384081525 2027 0.0

Keywords

target 1.0 potential 0.27559483344663493 docking 0.1955132562882393 analysis 0.1891683661907999 visualization 0.17965103104464084 between 0.1586222524359846 energy 0.09780194878767279 novel 0.09680489462950374 cell 0.0669385905279855 binding 0.0610469068660775 promising 0.05968728755948335 activity 0.04269204622705643 stability 0.0392476773170179 performance 0.038839791525039656 experimental 0.03331067301155676 interaction 0.032404260140493996 synthesized 0.028053478359392703 effective 0.02166326761840018 mechanism 0.02016768638114661 development 0.018536143213233627 including 0.01785633355993655 protein 0.006662134602311353 synthesis 0.006616813958758214 design 0.0018581463856786767 chemical 0.0
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