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Application

Discovery Studio 1.0 Materials Studio 0.9466878643349231 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06689390711546656 Amorphous Cell 0.2735406902428632 Blends 0.002272404487998864 CASTEP 0.37168015906831414 CDOCKER 0.17753160062491125 CHARMm 0.2756710694503622 COMPASS 0.35236472092032384 COMPASS III 0.07882403067746059 COSMObase 0.0031245561709984378 COSMOconf 0.004118733134497941 COSMOmic 2.84050560999858E-4 COSMOperm 0.001136202243999432 COSMOplex 2.84050560999858E-4 COSMOquick 0.0012782275244993609 COSMOtherm 0.060786820053969605 Cantera 0.0 Catalyst 0.11930123561994035 Classical Simulations 1.0 Conformers 0.0012782275244993609 Crystallization 0.07285896889646357 DFTB Plus 0.0039767078539980115 DMol3 0.1675898309899162 DPD 0.002414429768498793 Discover 0.0036926572929981537 Forcite 0.5236472092032382 GULP 0.022724044879988636 Kinetix 1.42025280499929E-4 LUDI 0.005965061780997018 LibDock 0.07271694361596365 LigandFit 0.006391137622496805 MCSS 0.001136202243999432 MODELER 0.20139184774889932 MesoDyn 0.0014202528049992898 Mesocite 0.0038346825734980826 Mesoscale 0.00695923874449652 Morphology 0.016474932537991763 ONETEP 9.941769634995029E-4 Polymorph 0.0014202528049992898 QMERA 1.42025280499929E-4 QSAR 7.101264024996449E-4 Quantum Mechanics 0.5289021445817356 Reflex 0.0543956824314728 Reflex Plus 2.84050560999858E-4 Semi-empirical 0.005681011219997159 Sorption 0.05325948018747337 Synthia 5.68101121999716E-4 TURBOMOLE 5.68101121999716E-4 VAMP 0.0012782275244993609 Visualization 0.8314159920465843 X-Cell 0.0012782275244993609 ZDOCK 0.030109359465984944

Year

2021 0.004612045577862181 2022 0.20293000542593598 2023 0.29259359739555074 2024 0.6819045035268584 2025 1.0 2026 0.4814161692892024 2027 0.0

Keywords

target 1.0 potential 0.28977450184271347 docking 0.23274408145418202 visualization 0.20844524954712973 analysis 0.19863826597538883 between 0.15197701293022675 novel 0.10731463551752139 binding 0.0847023549253545 energy 0.08189143606721219 cell 0.06277718783184459 promising 0.061777750015616216 activity 0.057342744706102816 stability 0.03954025860453495 interaction 0.038915609969392216 synthesized 0.0289212318071085 effective 0.02561059404085202 performance 0.025485664313823476 experimental 0.024548691361109376 protein 0.024548691361109376 mechanism 0.023924042725966644 including 0.022175026547566992 development 0.020051221188081704 synthesis 0.01530389156099694 design 0.00543444312574177 chemical 0.0
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