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Application

Discovery Studio 0.9441245747186601 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06271661990427463 Amorphous Cell 0.2851955768278594 Blends 0.001980524839082357 CASTEP 0.3520382901468889 CDOCKER 0.16157781812180227 CHARMm 0.25548770424162404 COMPASS 0.35121307146393793 COMPASS III 0.10166694173956098 COSMObase 0.004291137151345106 COSMOconf 0.005446443307476481 COSMOmic 1.6504373659019642E-4 COSMOperm 4.951312097705892E-4 COSMOplex 1.6504373659019642E-4 COSMOquick 0.0013203498927215713 COSMOtherm 0.06651262584584915 Catalyst 0.08631787423667271 Classical Simulations 1.0 Conformers 3.3008747318039283E-4 Crystallization 0.07195906915332563 DFTB Plus 0.00412609341475491 DMol3 0.15877207459976894 DPD 0.0018154811024921605 Discover 0.003630962204984321 Forcite 0.5355669252351873 GULP 0.020465423337184353 Kinetix 1.6504373659019642E-4 LUDI 0.003300874731803928 LibDock 0.06783297573857072 LigandFit 0.00412609341475491 MCSS 3.3008747318039283E-4 MODELER 0.24558508004621224 MesoDyn 6.601749463607857E-4 Mesocite 0.0026406997854431426 Mesoscale 0.004951312097705892 Modules 0.0 Morphology 0.017164548605380425 ONETEP 8.25218682950982E-4 Polymorph 0.001980524839082357 QMERA 1.6504373659019642E-4 QSAR 6.601749463607857E-4 Quantum Mechanics 0.5012378280244265 Reflex 0.05198877702591187 Reflex Plus 9.902624195411785E-4 Semi-empirical 0.005776530780656874 Sorption 0.05743522033338835 Synthia 9.902624195411785E-4 TURBOMOLE 3.3008747318039283E-4 VAMP 0.0011553061561313748 Visualization 0.7080376299719425 X-Cell 0.001650437365901964 ZDOCK 0.0275623040105628

Year

2023 0.01953773464436215 2024 0.49061422551398287 2025 1.0 2026 0.542331758396118 2027 0.0

Keywords

target 1.0 potential 0.2964260686755431 docking 0.2082068052635677 analysis 0.20742817098808689 visualization 0.1639025149887098 between 0.15035427859534375 novel 0.09577201588413922 energy 0.08354745775909056 promising 0.07871992525110956 binding 0.06633964027096473 cell 0.06361442030678191 activity 0.046718056528848396 performance 0.04087829946274235 stability 0.039321030911780734 including 0.01977731059721249 experimental 0.018297905473798958 synthesized 0.017986451763606633 effective 0.015962002647356536 development 0.015728412364712296 mechanism 0.014871914661683408 interaction 0.01284746554543331 enhanced 0.009810791871058164 strong 0.001868722261153936 protein 0.0010900879856731293 design 0.0
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