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Application

Discovery Studio 0.9048085793357934 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.069533034097173 Amorphous Cell 0.28309315694149145 Blends 0.0025986298133711316 CASTEP 0.4193243562485235 CDOCKER 0.16111504842901017 CHARMm 0.24143633356957242 COMPASS 0.3816835971336326 COMPASS III 0.07536026458776282 COSMObase 0.0029923616032758484 COSMOconf 0.0033860933931805655 COSMOmic 2.3623907394283014E-4 COSMOperm 0.0013386880856760374 COSMOplex 3.937317899047169E-4 COSMOquick 0.0014961808016379242 COSMOtherm 0.06472950626033545 Cantera 7.874635798094339E-5 Catalyst 0.11670210252775809 Classical Simulations 1.0 Conformers 0.0011024490117332074 Crystallization 0.07756516261122923 DFTB Plus 0.006220962280494527 DMol3 0.1931648161272541 DPD 0.0031498543192377353 Discover 0.00464603512087566 Forcite 0.5446098117962044 GULP 0.027167493503425465 Kinetix 2.3623907394283014E-4 LUDI 0.004567288762894716 LibDock 0.06630443341995433 LigandFit 0.006220962280494527 MCSS 8.662099377903772E-4 MODELER 0.16891093786912356 MesoDyn 0.001653673517599811 Mesocite 0.004252303330970942 Mesoscale 0.007874635798094339 Modules 0.0 Morphology 0.01834790140955981 ONETEP 0.0011811953697141507 Polymorph 0.0019686589495235846 QMERA 2.3623907394283014E-4 QSAR 0.001417434443656981 Quantum Mechanics 0.5995747696669029 Reflex 0.05693361682022206 Reflex Plus 7.087172218284905E-4 Semi-empirical 0.008425860303960942 Sorption 0.05622489959839357 Synthia 0.0014961808016379242 TURBOMOLE 5.512245058666037E-4 VAMP 0.0018111662335616977 Visualization 0.8076226474525553 X-Cell 0.0011811953697141507 ZDOCK 0.028269942515158675

Year

2020 0.0 2021 0.0691796396711562 2022 0.2463704740248382 2023 0.44026587370998777 2024 0.982071016267273 2025 1.0 2026 0.3726604862690222 2027 8.745845723281442E-4

Keywords

target 1.0 potential 0.2586613769280755 docking 0.19833099627210232 visualization 0.19258524573343822 analysis 0.17726324429700058 between 0.1559560860494545 novel 0.09507849105646568 energy 0.09206881220287971 binding 0.06115120216149663 cell 0.06026197886384623 promising 0.04545299086836075 activity 0.043537740688806045 interaction 0.036355552515475904 experimental 0.031601627962652624 stability 0.030233592120113548 synthesized 0.02650569444919457 performance 0.024727247853893772 mechanism 0.018571086562467937 effective 0.017510858784500153 development 0.014535380826977667 protein 0.010157666130852628 including 0.009678853585963952 synthesis 0.009200041041075276 chemical 0.0027360716850781492 design 0.0
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