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Application

Discovery Studio 0.9023861171366594 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06900369003690036 Amorphous Cell 0.2867158671586716 Blends 0.0034440344403444036 CASTEP 0.4137761377613776 CDOCKER 0.16063960639606395 CHARMm 0.23493234932349324 COMPASS 0.3846248462484625 COMPASS III 0.07712177121771217 COSMObase 0.002706027060270603 COSMOconf 0.004305043050430504 COSMOmic 1.230012300123001E-4 COSMOperm 0.001107011070110701 COSMOplex 3.6900369003690036E-4 COSMOquick 0.001107011070110701 COSMOtherm 0.06900369003690036 Cantera 0.0 Catalyst 0.11365313653136531 Classical Simulations 1.0 Conformers 0.0013530135301353015 Crystallization 0.07884378843788438 DFTB Plus 0.006273062730627306 DMol3 0.18880688806888068 DPD 0.0033210332103321034 Discover 0.005289052890528906 Forcite 0.5522755227552275 GULP 0.024108241082410824 Kinetix 2.460024600246002E-4 LUDI 0.005043050430504305 LibDock 0.06309963099630997 LigandFit 0.007011070110701107 MCSS 8.610086100861009E-4 MODELER 0.1795817958179582 MesoDyn 0.001107011070110701 Mesocite 0.004674046740467405 Mesoscale 0.008118081180811807 Morphology 0.01857318573185732 ONETEP 0.0014760147601476014 Polymorph 0.0018450184501845018 QMERA 2.460024600246002E-4 QSAR 0.0014760147601476014 Quantum Mechanics 0.5918819188191882 Reflex 0.05768757687576876 Reflex Plus 3.6900369003690036E-4 Semi-empirical 0.008364083640836408 Sorption 0.05522755227552276 Synthia 0.001107011070110701 TURBOMOLE 6.150061500615006E-4 VAMP 0.0015990159901599016 Visualization 0.8033210332103321 X-Cell 0.0013530135301353015 ZDOCK 0.02816728167281673

Year

2020 0.0 2021 0.18458596852478307 2022 0.25327254007942346 2023 0.5113987351081042 2024 0.8683629945580232 2025 1.0 2026 0.5236064127077511 2027 4.4124135902338577E-4

Keywords

target 1.0 potential 0.2526615765136036 docking 0.1940531239918271 visualization 0.18964404774706958 analysis 0.17528766534035917 between 0.15168297666415745 novel 0.08952575545757609 energy 0.08764383267017958 cell 0.0610818367566405 binding 0.05866222174427358 activity 0.045811377567480376 promising 0.044252070115066135 experimental 0.031239918270781805 interaction 0.03091730293579955 stability 0.027637380363479944 synthesized 0.024680073126142597 performance 0.02177653511130229 mechanism 0.019249381653941283 effective 0.015270459189160125 development 0.012743305731799118 including 0.006398537477148081 synthesis 0.006290999032153995 protein 0.003925153242284116 chemical 0.002258307344875793 design 0.0
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