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Application

Discovery Studio 0.8769886940626904 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0694137168141593 Amorphous Cell 0.28438421828908556 Blends 0.0025811209439528023 CASTEP 0.41390117994100295 CDOCKER 0.1528392330383481 CHARMm 0.23820058997050148 COMPASS 0.37582964601769914 COMPASS III 0.08130530973451328 COSMObase 0.0034107669616519174 COSMOconf 0.003963864306784661 COSMOmic 1.8436578171091445E-4 COSMOperm 0.0012905604719764012 COSMOplex 2.765486725663717E-4 COSMOquick 0.0014749262536873156 COSMOtherm 0.06600294985250738 Cantera 9.218289085545723E-5 Catalyst 0.10683997050147492 Classical Simulations 1.0 Conformers 0.0010140117994100295 Crystallization 0.0758665191740413 DFTB Plus 0.006084070796460177 DMol3 0.1889749262536873 DPD 0.0026733038348082595 Discover 0.004148230088495576 Forcite 0.5462758112094396 GULP 0.02654867256637168 Kinetix 2.765486725663717E-4 LUDI 0.004240412979351032 LibDock 0.0650811209439528 LigandFit 0.005070058997050148 MCSS 0.0010140117994100295 MODELER 0.18086283185840707 MesoDyn 0.0014749262536873156 Mesocite 0.0037794985250737463 Mesoscale 0.007098082595870207 Modules 0.0 Morphology 0.01760693215339233 ONETEP 0.0011061946902654867 Polymorph 0.0019358407079646017 QMERA 1.8436578171091445E-4 QSAR 0.0012905604719764012 Quantum Mechanics 0.5902470501474927 Reflex 0.055678466076696166 Reflex Plus 8.29646017699115E-4 Semi-empirical 0.008019911504424779 Sorption 0.057614306784660764 Synthia 0.00165929203539823 TURBOMOLE 6.452802359882006E-4 VAMP 0.0015671091445427728 Visualization 0.7742441002949852 X-Cell 0.0012905604719764012 ZDOCK 0.026456489675516223

Year

2020 0.0 2021 0.03114552173147985 2022 0.14763329227520675 2023 0.29051557276086576 2024 0.7894597923631884 2025 1.0 2026 0.3748900228752419 2027 8.798169980644026E-4

Keywords

target 1.0 potential 0.26624841103866814 docking 0.19608807971460204 visualization 0.18374543814327304 analysis 0.18067002911387214 between 0.15733792594415058 novel 0.09525566900397753 energy 0.09353343994751302 cell 0.059662935170377664 binding 0.05785869520646246 promising 0.052035920777463406 activity 0.04018534465083856 interaction 0.03268134661910034 experimental 0.032025259359494816 stability 0.03186123754459343 performance 0.031041128470086523 synthesized 0.025464386763439536 mechanism 0.016976257842293025 effective 0.016607208758764917 development 0.015090006970927133 including 0.011973592487800878 protein 0.006601878049780621 synthesis 0.005535736252921639 design 2.870381760774183E-4 chemical 0.0
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