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Application

Discovery Studio 1.0 Materials Studio 0.9864447323831357 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06317411402157165 Amorphous Cell 0.2792758089368259 Blends 0.002182845403184386 CASTEP 0.3662044170518747 CDOCKER 0.16679506933744223 CHARMm 0.2674627632254751 COMPASS 0.3489984591679507 COMPASS III 0.09116589625064202 COSMObase 0.003852080123266564 COSMOconf 0.004622496147919877 COSMOmic 1.2840267077555214E-4 COSMOperm 8.988186954288649E-4 COSMOplex 1.2840267077555214E-4 COSMOquick 0.0015408320493066256 COSMOtherm 0.06420133538777606 Cantera 0.0 Catalyst 0.1118387262455059 Classical Simulations 1.0 Conformers 6.420133538777606E-4 Crystallization 0.07126348228043143 DFTB Plus 0.004750898818695429 DMol3 0.16409861325115563 DPD 0.0024396507447354905 Discover 0.0035952747817154596 Forcite 0.5299178222907036 GULP 0.020672829994863893 Kinetix 1.2840267077555214E-4 LUDI 0.004365690806368772 LibDock 0.07023626091422702 LigandFit 0.004879301489470981 MCSS 6.420133538777606E-4 MODELER 0.22303543913713406 MesoDyn 7.704160246533128E-4 Mesocite 0.0032100667693888032 Mesoscale 0.005906522855675398 Modules 0.0 Morphology 0.01682074987159733 ONETEP 0.0011556240369799693 Polymorph 0.001926040061633282 QMERA 1.2840267077555214E-4 QSAR 8.988186954288649E-4 Quantum Mechanics 0.5200308166409862 Reflex 0.05187467899332306 Reflex Plus 0.001027221366204417 Semi-empirical 0.0064201335387776065 Sorption 0.055983564458140726 Synthia 7.704160246533128E-4 TURBOMOLE 5.136106831022085E-4 VAMP 0.0012840267077555213 Visualization 0.7925012840267077 X-Cell 0.0015408320493066256 ZDOCK 0.02773497688751926

Year

2022 0.0 2023 0.21190261496844004 2024 0.5102695120729386 2025 1.0 2026 0.425708846808937 2027 0.0

Keywords

target 1.0 potential 0.29444444444444445 docking 0.22471064814814815 analysis 0.20266203703703703 visualization 0.19207175925925926 between 0.15104166666666666 novel 0.1005787037037037 energy 0.08206018518518518 binding 0.07390046296296296 promising 0.06822916666666666 cell 0.061342592592592594 activity 0.05202546296296296 stability 0.038483796296296294 performance 0.03136574074074074 interaction 0.026157407407407407 synthesized 0.025983796296296297 experimental 0.02228009259259259 including 0.019849537037037037 development 0.01846064814814815 effective 0.017939814814814815 mechanism 0.017418981481481483 protein 0.01545138888888889 synthesis 0.008043981481481482 design 0.0010416666666666667 enhanced 0.0
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