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Application

Discovery Studio 0.8742275536168665 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05411350637923449 Amorphous Cell 0.278926528816542 Blends 0.0017597888253409592 CASTEP 0.3040035195776507 CDOCKER 0.15310162780466344 CHARMm 0.24593048834139902 COMPASS 0.3501979762428509 COMPASS III 0.11878574571051474 COSMObase 0.005279366476022877 COSMOconf 0.007919049714034315 COSMOmic 0.0 COSMOperm 4.399472063352398E-4 COSMOplex 4.399472063352398E-4 COSMOquick 4.399472063352398E-4 COSMOtherm 0.06467223933128025 Catalyst 0.06775186977562693 Classical Simulations 1.0 Conformers 4.399472063352398E-4 Crystallization 0.075230972283326 DFTB Plus 0.0030796304443466782 DMol3 0.13902331720193578 DPD 0.0013198416190057193 Discover 0.004399472063352398 Forcite 0.5411350637923449 GULP 0.015398152221733392 Kinetix 0.0 LUDI 0.0017597888253409592 LibDock 0.062032556093268805 LigandFit 0.0030796304443466782 MODELER 0.22393312802463705 Mesocite 0.003959524857017158 Mesoscale 0.004839419269687638 Morphology 0.01715794104707435 ONETEP 8.798944126704796E-4 Polymorph 0.0035195776506819184 QMERA 0.0 QSAR 0.0 Quantum Mechanics 0.4368675758908931 Reflex 0.05323361196656401 Reflex Plus 4.399472063352398E-4 Semi-empirical 0.003959524857017158 Sorption 0.06599208095028597 Synthia 8.798944126704796E-4 TURBOMOLE 0.0 VAMP 0.0 Visualization 0.6159260888693356 X-Cell 0.0013198416190057193 ZDOCK 0.027276726792784867

Year

2024 0.012316113581936367 2025 0.8994184057475196 2026 1.0 2027 0.0

Keywords

target 1.0 potential 0.3051665861902463 analysis 0.21704490584258812 docking 0.19797199420569772 visualization 0.1393046837276678 between 0.13037180106228874 promising 0.09270883631096088 novel 0.07967165620473202 energy 0.0779816513761468 cell 0.060598744567841624 binding 0.05915016900048286 performance 0.04635441815548044 stability 0.04007725736359247 strong 0.03355866731047803 activity 0.030661516175760503 including 0.022935779816513763 strategy 0.01521004345726702 enhanced 0.01496861419604056 effective 0.01158860453887011 experimental 0.008691453404152583 development 0.00748430709802028 mechanism 4.828585224529213E-4 synthesized 4.828585224529213E-4 design 2.4142926122646064E-4 therapeutic 0.0
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