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Application

Discovery Studio 1.0 Materials Studio 0.9403409090909091 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0667739340305712 Amorphous Cell 0.2747832305354429 Blends 0.002413515687851971 CASTEP 0.3951908465182801 CDOCKER 0.18011978188969338 CHARMm 0.26968803074997766 COMPASS 0.36390453204612494 COMPASS III 0.07535532314293376 COSMObase 0.0030392419772950745 COSMOconf 0.003664968266738178 COSMOmic 2.681684097613301E-4 COSMOperm 0.0015196209886475373 COSMOplex 3.575578796817735E-4 COSMOquick 0.001430231518727094 COSMOtherm 0.0634665236435148 Cantera 0.0 Catalyst 0.13399481541074462 Classical Simulations 1.0 Conformers 0.0010726736390453205 Crystallization 0.07499776526325198 DFTB Plus 0.0058997050147492625 DMol3 0.17967283454009117 DPD 0.003307410387056405 Discover 0.004111915616340395 Forcite 0.526414588361491 GULP 0.025654777867167248 Kinetix 2.681684097613301E-4 LUDI 0.0053633681952266025 LibDock 0.07437203897380888 LigandFit 0.006972378653794583 MCSS 9.832841691248771E-4 MODELER 0.18378475015643156 MesoDyn 0.0016983999284884241 Mesocite 0.004022526146419952 Mesoscale 0.007866273352999017 Modules 0.0 Morphology 0.017788504514168232 ONETEP 0.0010726736390453205 Polymorph 0.0018771788683293108 QMERA 1.7877893984088674E-4 QSAR 0.0011620631089657638 Quantum Mechanics 0.5632430499687137 Reflex 0.05488513453115223 Reflex Plus 7.15115759363547E-4 Semi-empirical 0.007866273352999017 Sorption 0.0539912398319478 Synthia 0.0015196209886475373 TURBOMOLE 5.363368195226602E-4 VAMP 0.0016090104585679806 Visualization 0.8877268257799231 X-Cell 0.001251452578886207 ZDOCK 0.03101814606239385

Year

2021 0.039619361332235335 2022 0.289962485131302 2023 0.38695214566749014 2024 0.908408820569128 2025 1.0 2026 0.3200658797694208 2027 0.0

Keywords

target 1.0 potential 0.2586564601516669 docking 0.21512376591787094 visualization 0.20428530548004006 analysis 0.17302189154385464 between 0.14326083846043783 novel 0.0987623408212906 energy 0.07554728859636571 binding 0.07207755043640006 cell 0.056088138503362424 activity 0.05319072828730863 promising 0.04603662898841036 interaction 0.038524824724567176 synthesized 0.0301545285448562 stability 0.027507511804263845 experimental 0.025289741021605378 protein 0.022285019316068105 effective 0.018242953212190584 mechanism 0.01752754328230076 development 0.01677636285591644 synthesis 0.016597510373443983 performance 0.014343969094291028 including 0.01148232937473172 design 3.9347546143940476E-4 chemical 0.0
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